SMILE
stringlengths 1
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stringlengths 3
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|---|---|
COC(C(C)C=CCC(=O)OCCCc1ccccc1)C1CCCCC1 | [C][O][C][Branch2][Ring1][Branch2][C][Branch1][C][C][C][=C][C][C][=Branch1][C][=O][O][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][C][C][C][Ring1][=Branch1] |
O=C(Cc1ccccc1)Nc1nnc(OC2CCCN(c3nnc(NC(=O)Cc4ccccc4)s3)C2)s1 | [O][=C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=N][N][=C][Branch2][Ring2][Branch1][O][C][C][C][C][N][Branch2][Ring1][Branch2][C][=N][N][=C][Branch1][#C][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][S][Ring1][#C][C][Ring2][Ring1][Branch1][S][Ring2][Ring1][O] |
COc1ccc(C=C2C(=O)NC(=S)N2C(=O)c2ccc(C)cc2)cc1 | [C][O][C][=C][C][=C][Branch2][Ring1][=C][C][=C][C][=Branch1][C][=O][N][C][=Branch1][C][=S][N][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][C][=C][Ring2][Ring1][#Branch1] |
CC1CN(C(C)CO)C(=O)c2cc(NC(=O)Cc3cn(C)c4ccccc34)ccc2OC1CN(C)Cc1ccncc1 | [C][C][C][N][Branch1][#Branch1][C][Branch1][C][C][C][O][C][=Branch1][C][=O][C][=C][C][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][C][=C][N][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1][=C][C][=C][Ring2][Ring1][Ring2][O][C][Ring2][Ring1][#C][C][N][Branch1][C][C][C][C][=C][C][=N][C][=C][Ring1][=Branch1] |
COc1ccccc1Cc1cc(-c2ccccc2)n[nH]c1=NN=Cc1cc(OC)c(OCCOc2c(OC)cc(C=O)cc2OC)c(OC)c1 | [C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][NH1][C][Ring1][N][=N][N][=C][C][=C][C][Branch1][Ring1][O][C][=C][Branch2][Ring1][#Branch1][O][C][C][O][C][=C][Branch1][Ring1][O][C][C][=C][Branch1][Ring1][C][=O][C][=C][Ring1][#Branch2][O][C][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][#Branch2] |
CC1OC(n2cc(-c3ccccc3)c3c(NCC(=O)NCCCN(C)C)ncnc32)C(O)C1O | [C][C][O][C][Branch2][Ring2][#Branch2][N][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Branch1][S][N][C][C][=Branch1][C][=O][N][C][C][C][N][Branch1][C][C][C][N][=C][N][=C][Ring1][P][Ring2][Ring1][#Branch2][C][Branch1][C][O][C][Ring2][Ring1][S][O] |
COc1cc(Cl)ccc1-c1nccc2cc(S(=O)(=O)Nc3ncns3)ccc12 | [C][O][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][C][=N][C][=C][C][=C][C][Branch1][S][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=N][C][=N][S][Ring1][Branch1][=C][C][=C][Ring2][Ring1][Ring1][Ring1][#C] |
NC(CCCSc1cc(Cl)ccc1O)C(=O)O | [N][C][Branch1][P][C][C][C][S][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][O][C][=Branch1][C][=O][O] |
O=C(c1ccc(N2CCCC2=O)cc1)N1CCN(c2ccccc2Cl)CC1 | [O][=C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][N][C][C][C][C][Ring1][Branch1][=O][C][=C][Ring1][N][N][C][C][N][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C][C][Ring1][=N] |
CCN(CCNC(=O)c1cc(Cl)c(N)cc1OC)Cc1ccoc1 | [C][C][N][Branch2][Ring1][Branch2][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=C][Branch1][C][N][C][=C][Ring1][Branch2][O][C][C][C][C][=C][O][C][=Ring1][Branch1] |
Cc1cc(C2CC3CCC(C2)N3C)on1 | [C][C][C][=C][Branch1][S][C][C][C][C][C][C][Branch1][Ring2][C][Ring1][#Branch1][N][Ring1][=Branch1][C][O][N][=Ring1][=C] |
N=C(N)c1ccc(C=Cc2ccc3c(c2)CCN(CC(=O)O)C3=O)cc1 | [N][=C][Branch1][C][N][C][=C][C][=C][Branch2][Ring1][N][C][=C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][N][Branch1][#Branch1][C][C][=Branch1][C][=O][O][C][Ring1][O][=O][C][=C][Ring2][Ring1][#Branch1] |
N#CC1(n2cc(C(NC(=O)c3cccs3)C3CCCCC3)nn2)CC1 | [N][#C][C][Branch2][Ring2][Ring1][N][C][=C][Branch2][Ring1][Branch2][C][Branch1][=N][N][C][=Branch1][C][=O][C][=C][C][=C][S][Ring1][Branch1][C][C][C][C][C][C][Ring1][=Branch1][N][=N][Ring2][Ring1][Ring2][C][C][Ring2][Ring1][#Branch1] |
Cc1ccc(C2=NOC3(C2)OC(CO)C(O)C(O)C3O)cc1 | [C][C][=C][C][=C][Branch2][Ring1][N][C][=N][O][C][Branch1][Ring2][C][Ring1][Branch1][O][C][Branch1][Ring1][C][O][C][Branch1][C][O][C][Branch1][C][O][C][Ring1][O][O][C][=C][Ring2][Ring1][Branch1] |
NC(Cn1cc(I)c(=O)n(CCc2nn[nH]n2)c1=O)C(=O)O | [N][C][Branch2][Ring1][N][C][N][C][=C][Branch1][C][I][C][=Branch1][C][=O][N][Branch1][#Branch2][C][C][C][N][=N][NH1][N][=Ring1][Branch1][C][Ring1][#C][=O][C][=Branch1][C][=O][O] |
c1ccc2c(c1)Nc1nc3ccccc3cc1S2 | [C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][#Branch2][S][Ring1][#C] |
Cc1ccc(NC2=CC(=O)c3[se]c(C)nc3C2=O)cc1 | [C][C][=C][C][=C][Branch2][Ring1][=Branch1][N][C][=C][C][=Branch1][C][=O][C][Se][C][Branch1][C][C][=N][C][=Ring1][=Branch1][C][Ring1][O][=O][C][=C][Ring2][Ring1][Ring1] |
O=C1CC2(CCCC2)CC(=O)N1CCN1CCN(c2ccccc2O)CC1 | [O][=C][C][C][Branch1][#Branch1][C][C][C][C][Ring1][Branch1][C][C][=Branch1][C][=O][N][Ring1][O][C][C][N][C][C][N][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][Ring1][=N] |
O=C1C(NC(=S)Nc2ccnc3cc(Cl)ccc23)C(C=Cc2ccccc2)N1C1CCCCC1 | [O][=C][C][Branch2][Ring1][Branch2][N][C][=Branch1][C][=S][N][C][=C][C][=N][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][O][Ring1][#Branch1][C][Branch1][O][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring2][Ring1][O][C][C][C][C][C][C][Ring1][=Branch1] |
CCN(Cc1cnn(C)c1)Cc1nc(C2(c3ccc(C)cc3)CCCC2)no1 | [C][C][N][Branch1][N][C][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][C][=N][C][Branch2][Ring1][Branch1][C][Branch1][N][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][C][C][C][C][Ring1][N][=N][O][Ring1][P] |
COC(Cc1scnc1C(=O)Nc1nccs1)C(C)C | [C][O][C][Branch2][Ring1][Branch1][C][C][S][C][=N][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][=N][C][=C][S][Ring1][Branch1][C][Branch1][C][C][C] |
COc1cccc(C(=O)NC2CCc3c(Cl)c(OC)c(OC)c(OC)c3-c3ccc(OC)c(=O)cc32)c1 | [C][O][C][=C][C][=C][C][Branch2][Branch1][Ring1][C][=Branch1][C][=O][N][C][C][C][C][=C][Branch1][C][Cl][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][=N][C][=C][C][=C][Branch1][Ring1][O][C][C][=Branch1][C][=O][C][=C][Ring1][#Branch2][Ring2][Ring1][#Branch2][=C][Ring2][Ring2][Ring1] |
COc1ccc(C2=NN(C(C)=O)C(c3ccc(NS(=O)(=O)c4cc(F)ccc4C)cc3)C2)cc1OC | [C][O][C][=C][C][=C][Branch2][Branch1][Ring1][C][=N][N][Branch1][=Branch1][C][Branch1][C][C][=O][C][Branch2][Ring1][P][C][=C][C][=C][Branch2][Ring1][Branch1][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][C][C][=C][Ring2][Ring1][C][C][Ring2][Ring1][#Branch2][C][=C][Ring2][Ring1][S][O][C] |
Cc1ccc(S(=O)(=O)N2CCC(C(=O)NC3CC3)CC2)cc1 | [C][C][=C][C][=C][Branch2][Ring1][N][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][Branch1][O][C][=Branch1][C][=O][N][C][C][C][Ring1][Ring1][C][C][Ring1][N][C][=C][Ring2][Ring1][Branch1] |
Nc1nc(OCCc2cccc3ccccc23)nc2c1ncn2C1OC(CO)C(O)C1O | [N][C][=N][C][Branch2][Ring1][C][O][C][C][C][=C][C][=C][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1][=N][C][=C][Ring2][Ring1][Ring1][N][=C][N][Ring1][Branch1][C][O][C][Branch1][Ring1][C][O][C][Branch1][C][O][C][Ring1][Branch2][O] |
CC(=O)N1CCCC(C(=O)N2CCN(Cc3cc(C)on3)CC2)C1 | [C][C][=Branch1][C][=O][N][C][C][C][C][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C][N][Branch1][N][C][C][C][=C][Branch1][C][C][O][N][=Ring1][=Branch1][C][C][Ring1][=N][C][Ring2][Ring1][Branch1] |
CC(C)C(=O)N(Cc1cc(=O)[nH]c2c(F)cccc12)c1cccc(Cl)c1 | [C][C][Branch1][C][C][C][=Branch1][C][=O][N][Branch2][Ring1][=Branch1][C][C][=C][C][=Branch1][C][=O][NH1][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][N][Ring1][#Branch1][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1] |
O=C1CCCC2=C1C1OC(CCCCN3C(=O)c4ccccc4C3=O)(Cc3ccccc31)O2 | [O][=C][C][C][C][C][=C][Ring1][=Branch1][C][O][C][Branch2][Ring1][=Branch1][C][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][=O][Branch1][=N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][=Branch2][O][Ring2][Ring1][N] |
O=C(NC(=O)N(SSN(C(=O)NC(=O)c1ccccc1Cl)c1ccc(OC(F)(F)F)cc1)c1ccc(OC(F)(F)F)cc1)c1ccccc1Cl | [O][=C][Branch2][=Branch1][Branch2][N][C][=Branch1][C][=O][N][Branch2][Ring2][N][S][S][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C][=C][C][=C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][O][C][=C][C][=C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl] |
CCCc1cc(N)c2cc(NC(=O)C=Cc3ccc(C(C)(C)C)cc3)ccc2n1 | [C][C][C][C][=C][C][Branch1][C][N][=C][C][=C][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring1][#Branch2][C][=C][C][Ring2][Ring1][Branch1][=N][Ring2][Ring1][#Branch2] |
COC(=O)CN1C(=O)C(O)(CC(=O)c2cccc(Br)c2)c2ccccc21 | [C][O][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][Branch1][C][O][Branch1][P][C][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][Br][=C][Ring1][#Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][Branch1] |
O=C(O)CCNC(=O)c1ncc2ccc(Oc3ccccc3)cc2c1O | [O][=C][Branch1][C][O][C][C][N][C][=Branch1][C][=O][C][=N][C][=C][C][=C][C][Branch1][#Branch2][O][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][C][Ring1][=N][=C][Ring1][P][O] |
C=C(CC)C(=O)c1ccc(OCC(=O)NCCCC(=O)NCc2cccc(C(N)=O)c2)c(Cl)c1Cl | [C][=C][Branch1][Ring1][C][C][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][S][O][C][C][=Branch1][C][=O][N][C][C][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][Branch1][=Branch1][C][Branch1][C][N][=O][=C][Ring1][=Branch2][C][Branch1][C][Cl][=C][Ring2][Ring1][N][Cl] |
CC(=O)N1CCN(C(=O)N2CCC(c3ccc(C(OC(C)C)(C(F)(F)F)C(F)(F)F)cc3)(S(=O)(=O)c3ccc(F)cc3)C2)CC1 | [C][C][=Branch1][C][=O][N][C][C][N][Branch2][=Branch1][N][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring2][Branch2][C][=C][C][=C][Branch2][Ring1][N][C][Branch1][#Branch1][O][C][Branch1][C][C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring2][Ring1][Ring1][Branch2][Ring1][Ring1][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][Ring2][Ring2][C][C][C][Ring2][Ring2][#Branch2] |
COc1cccc(-c2c(C)n(Cc3c(F)cccc3F)c(=O)n(CC(C)NC3CCC3)c2=O)c1F | [C][O][C][=C][C][=C][C][Branch2][Ring2][=C][C][=C][Branch1][C][C][N][Branch1][=C][C][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][F][C][=Branch1][C][=O][N][Branch1][=N][C][C][Branch1][C][C][N][C][C][C][C][Ring1][Ring2][C][Ring2][Ring1][=Branch2][=O][=C][Ring2][Ring1][S][F] |
Cn1ccnc1[N+](=O)[O-] | [C][N][C][=C][N][=C][Ring1][Branch1][N+1][=Branch1][C][=O][O-1] |
CC(OC(=O)CN1C(=O)NC2(CCCC2)C1=O)C(=O)c1ccccc1 | [C][C][Branch2][Ring1][#Branch2][O][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][N][C][Branch1][#Branch1][C][C][C][C][Ring1][Branch1][C][Ring1][#Branch2][=O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1] |
C=CCN(C(=O)NCc1ccc(S(=O)(=O)NC)cc1)C1CCN(CC2CN(C(=O)C3CCCC3)CC2(O)c2ccccc2)CC1 | [C][=C][C][N][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch1][#Branch2][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][=C][Ring1][O][C][C][C][N][Branch2][Ring1][P][C][C][C][N][Branch1][N][C][=Branch1][C][=O][C][C][C][C][C][Ring1][Branch1][C][C][Ring1][N][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring2][Ring1][#Branch2] |
Oc1c(C(c2ccccc2)N2CCc3ccccc3C2)sc2ncnn12 | [O][C][=C][Branch2][Ring1][#Branch2][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][S][C][=N][C][=N][N][Ring2][Ring1][=Branch2][Ring1][Branch1] |
CCOC(=O)c1cn2nc(Oc3cccc(C(F)(F)F)c3)ccc2n1 | [C][C][O][C][=Branch1][C][=O][C][=C][N][N][=C][Branch2][Ring1][Ring2][O][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2][C][=C][C][Ring1][P][=N][Ring2][Ring1][Ring2] |
Cc1cc(C)cc(N(C(=O)c2csnn2)C(C(=O)NC(C)(C)C)c2cccs2)c1 | [C][C][=C][C][Branch1][C][C][=C][C][Branch2][Ring2][=Branch1][N][Branch1][N][C][=Branch1][C][=O][C][=C][S][N][=N][Ring1][Branch1][C][Branch1][=C][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C][C][=C][C][=C][S][Ring1][Branch1][=C][Ring2][Ring1][N] |
Cc1[nH]c2ccc(OC(=O)N3CCOCC3)cc2c1C(=O)OC(C)C | [C][C][NH1][C][=C][C][=C][Branch1][=C][O][C][=Branch1][C][=O][N][C][C][O][C][C][Ring1][=Branch1][C][=C][Ring1][#C][C][=Ring2][Ring1][C][C][=Branch1][C][=O][O][C][Branch1][C][C][C] |
CC(C)c1ccc(CNc2nnnn2C)cc1 | [C][C][Branch1][C][C][C][=C][C][=C][Branch1][O][C][N][C][=N][N][=N][N][Ring1][Branch1][C][C][=C][Ring1][=C] |
CC(C)Cn1ccc(N2CCC(c3ccccc3)CC2)c(Cl)c1=O | [C][C][Branch1][C][C][C][N][C][=C][C][Branch2][Ring1][Ring1][N][C][C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][N][=C][Branch1][C][Cl][C][Ring2][Ring1][Ring1][=O] |
CN(C#N)N(C)C(=O)C(Cc1ccc(O)cc1)NC(=O)OCc1ccccc1 | [C][N][Branch1][Ring1][C][#N][N][Branch1][C][C][C][=Branch1][C][=O][C][Branch1][=N][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CCCCc1nc(Cl)c(CO)n1CCCOc1cc2c(Nc3ccc(Br)cc3CC)ncnc2cc1OC | [C][C][C][C][C][=N][C][Branch1][C][Cl][=C][Branch1][Ring1][C][O][N][Ring1][Branch2][C][C][C][O][C][=C][C][=C][Branch1][#C][N][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][C][C][N][=C][N][=C][Ring1][S][C][=C][Ring2][Ring1][Ring2][O][C] |
CN(CC(NC(=O)NC1CCCCCCCCCC(C(=O)C(N)=O)NC(=O)C2C3C(CN2C1=O)C3(C)C)C(C)(C)C)S(C)(=O)=O | [C][N][Branch2][=Branch1][Ring2][C][C][Branch2][Branch1][#Branch1][N][C][=Branch1][C][=O][N][C][C][C][C][C][C][C][C][C][C][C][Branch1][#Branch2][C][=Branch1][C][=O][C][Branch1][C][N][=O][N][C][=Branch1][C][=O][C][C][C][Branch1][#Branch2][C][N][Ring1][Branch1][C][Ring2][Ring1][=Branch2][=O][C][Ring1][#Branch1][Branch1][C][C][C][C][Branch1][C][C][Branch1][C][C][C][S][Branch1][C][C][=Branch1][C][=O][=O] |
COC1C(=O)N2C(C(=O)N3CCCC3C(=O)O)=C(CSc3nc(=O)c(=O)[nH]n3C)CS(=O)(=O)C12 | [C][O][C][C][=Branch1][C][=O][N][C][Branch1][P][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1][C][=Branch1][C][=O][O][=C][Branch2][Ring1][C][C][S][C][=N][C][=Branch1][C][=O][C][=Branch1][C][=O][NH1][N][Ring1][Branch2][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][Ring2][Ring1][S][Ring2][Ring1][=N] |
CC(C)CC(NC(=O)C(CCc1ccccc1)NC(CCN1C(=O)c2ccccc2C1=O)C(=O)O)C(=O)Nc1ccccc1 | [C][C][Branch1][C][C][C][C][Branch2][Ring2][S][N][C][=Branch1][C][=O][C][Branch1][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][Branch2][Ring1][Ring2][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][=O][C][=Branch1][C][=O][O][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1] |
COC(=O)c1ccccc1NC(=O)CCS(=O)(=O)c1ccc(Br)cc1 | [C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1] |
COc1ccc(CC2NCCc3c2[nH]c2ccc(Br)cc32)cc1OC | [C][O][C][=C][C][=C][Branch2][Ring1][Branch2][C][C][N][C][C][C][=C][Ring1][=Branch1][NH1][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch2][Ring1][#Branch1][C][=C][Ring2][Ring1][Branch1][O][C] |
CN1C(=O)c2c(nc(Cc3ccccc3)n2CC2CCCCC2)N2C1=NC1CCCC12 | [C][N][C][=Branch1][C][=O][C][=C][Branch2][Ring1][#Branch2][N][=C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][N][C][C][C][C][C][C][C][Ring1][=Branch1][N][C][Ring2][Ring1][Branch2][=N][C][C][C][C][C][Ring1][Branch1][Ring1][Branch2] |
COc1cc(C(=O)NC2(C(=O)NC(C)c3ccc(-n4ncc5ccccc54)cc3F)CC2)on1 | [C][O][C][C][=C][Branch2][Ring2][S][C][=Branch1][C][=O][N][C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][Branch1][C][C][C][=C][C][=C][Branch1][=C][N][N][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=Branch2][C][=C][Ring1][#C][F][C][C][Ring2][Ring1][Branch2][O][N][=Ring2][Ring1][S] |
O=C(O)CCc1ccc(S(=O)(=O)Nc2ccc(OCc3ccccc3)cc2)cc1 | [O][=C][Branch1][C][O][C][C][C][=C][C][=C][Branch2][Ring1][=N][S][=Branch1][C][=O][=Branch1][C][=O][N][C][=C][C][=C][Branch1][O][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][=C][C][=C][Ring2][Ring1][Branch2] |
Cc1cccc(C)c1-n1c(-c2ccc(Cl)cc2)n[nH]c1=S | [C][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][N][C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][=N][NH1][C][Ring1][N][=S] |
COc1ccc(-c2nc3n(n2)C(c2ccccc2Cl)C(C(N)=O)=C(C)N3)cc1 | [C][O][C][=C][C][=C][Branch2][Ring2][=Branch1][C][N][=C][N][Branch1][Ring2][N][=Ring1][Branch1][C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C][Branch1][=Branch1][C][Branch1][C][N][=O][=C][Branch1][C][C][N][Ring2][Ring1][C][C][=C][Ring2][Ring1][#Branch2] |
Cc1ccc(C=CC(=NNC(=O)c2cccs2)c2ccc(Cl)cc2)cc1 | [C][C][=C][C][=C][Branch2][Ring1][=C][C][=C][C][=Branch1][=C][=N][N][C][=Branch1][C][=O][C][=C][C][=C][S][Ring1][Branch1][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=C][Ring2][Ring1][=Branch2] |
O=C(CC12CC3CC(CC(C3)C1)C2)NN=Cc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O | [O][=C][Branch2][Ring1][=Branch1][C][C][C][C][C][C][Branch1][O][C][C][Branch1][Ring2][C][Ring1][=Branch1][C][Ring1][=Branch2][C][Ring1][#Branch2][N][N][=C][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][N][O] |
CCCCOCCCNC(=O)CC1CC2(C(=O)OCC)CCCC=C2N(CCc2ccc(OC)c(OC)c2)C1=O | [C][C][C][C][O][C][C][C][N][C][=Branch1][C][=O][C][C][C][C][Branch1][Branch2][C][=Branch1][C][=O][O][C][C][C][C][C][C][=C][Ring1][O][N][Branch2][Ring1][Ring1][C][C][C][=C][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][#Branch2][C][Ring2][Ring1][O][=O] |
CC(C)C(NC(=O)COc1c(C(=O)O)ccc2ccccc12)C(=O)NC1CC(=O)OC1O | [C][C][Branch1][C][C][C][Branch2][Ring1][=N][N][C][=Branch1][C][=O][C][O][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][C][=C][C][=C][C][=C][Ring1][=N][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][=Branch1][C][=O][O][C][Ring1][=Branch1][O] |
NC(CC(=O)N1CCCC1CNC(=O)c1ccncc1)Cc1ccccc1F | [N][C][Branch2][Ring1][O][C][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1][C][N][C][=Branch1][C][=O][C][=C][C][=N][C][=C][Ring1][=Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][F] |
COC(=O)c1ccc(CNc2nc(Nc3cc(C)[nH]n3)cc(N3CCOCC3)n2)cc1 | [C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring2][Ring1][C][N][C][=N][C][Branch1][N][N][C][C][=C][Branch1][C][C][NH1][N][=Ring1][=Branch1][=C][C][Branch1][=Branch2][N][C][C][O][C][C][Ring1][=Branch1][=N][Ring2][Ring1][Ring1][C][=C][Ring2][Ring1][O] |
O=C1CC(c2ccccc2Cl)C2=C(COC2=O)N1 | [O][=C][C][C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C][=C][Branch1][#Branch1][C][O][C][Ring1][Branch1][=O][N][Ring1][P] |
CSc1ccc(C=C(NC(=O)c2ccc(C)cc2)C(=O)Nc2cccc(F)c2)cc1 | [C][S][C][=C][C][=C][Branch2][Ring2][Branch1][C][=C][Branch1][P][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][=C][Ring2][Ring1][N] |
O=C(c1cnccc1C(F)(F)F)N1CCCC(Oc2ccc(C(F)(F)F)cc2)(C(=O)N2CCN(c3ccccc3)CC2)C1 | [O][=C][Branch1][P][C][=C][N][=C][C][=C][Ring1][=Branch1][C][Branch1][C][F][Branch1][C][F][F][N][C][C][C][C][Branch2][Ring1][Ring2][O][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][N][C][Ring2][Ring1][#C] |
CC(C)(C)c1ccc(CN(CCC=Cc2ccccc2)n2cnnc2)cc1 | [C][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][Branch2][Ring1][Branch2][C][N][Branch1][=N][C][C][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=N][N][=C][Ring1][Branch1][C][=C][Ring2][Ring1][#Branch1] |
CS(=O)(=O)c1ccc(-c2cnc(C(=O)c3ccccc3)n2-c2ccc(F)cc2)cc1 | [C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][P][C][=C][N][=C][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][=N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=C][Ring2][Ring1][#Branch2] |
O=c1nc(-c2cccnc2Cl)ss1 | [O][=C][N][=C][Branch1][#Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][Cl][S][S][Ring1][N] |
Cc1cc(Cl)ccc1OCC(=O)Nc1ccncc1 | [C][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][O][C][C][=Branch1][C][=O][N][C][=C][C][=N][C][=C][Ring1][=Branch1] |
Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)Nc2ccc(OC(F)(F)F)cc2)CC1 | [C][C][=N][O][C][Branch1][C][C][=C][Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][O][C][C][Ring2][Ring1][Ring2] |
CNC(=O)CCNC(=O)c1cc(Br)c2c(c1)OCCO2 | [C][N][C][=Branch1][C][=O][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][Br][=C][C][=Branch1][Ring2][=C][Ring1][#Branch1][O][C][C][O][Ring1][#Branch1] |
COc1ccc(C(=O)OC(C)C)cc1CSc1nc2ccccc2n1CC(=O)O | [C][O][C][=C][C][=C][Branch1][O][C][=Branch1][C][=O][O][C][Branch1][C][C][C][C][=C][Ring1][N][C][S][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][=Branch2][C][C][=Branch1][C][=O][O] |
Cc1c(NC(=O)C(C)OC(=O)c2ccc(NC(=O)CC#N)cc2)c(=O)n(-c2ccccc2)n1C | [C][C][=C][Branch2][Ring1][P][N][C][=Branch1][C][=O][C][Branch1][C][C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch2][N][C][=Branch1][C][=O][C][C][#N][C][=C][Ring1][N][C][=Branch1][C][=O][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring2][Ring1][S][C] |
O=C(c1cc2cc([N+](=O)[O-])ccc2oc1=O)N1CCOCC1 | [O][=C][Branch2][Ring1][#Branch1][C][=C][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][C][=C][Ring1][=Branch2][O][C][Ring1][=N][=O][N][C][C][O][C][C][Ring1][=Branch1] |
CC(CCC(=O)NCc1ccccc1)C1CCC2C3CCC4CC(N=[N+]=[N-])CCC4(C)C3CC(O)C12C | [C][C][Branch1][P][C][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][C][C][C][C][C][C][C][Branch1][Ring2][N][=N+1][=N-1][C][C][C][Ring1][=Branch2][Branch1][C][C][C][Ring1][=C][C][C][Branch1][C][O][C][Ring2][Ring1][=Branch1][Ring2][Ring1][Ring1][C] |
CC(C)=CCOc1ccc(C2=C(CC(C)C)C(=O)N(C(c3ccccc3)C(O)C(=O)O)C2=O)cc1 | [C][C][Branch1][C][C][=C][C][O][C][=C][C][=C][Branch2][Ring2][N][C][=C][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][Branch2][Ring1][Branch1][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][O][C][=Branch1][C][=O][O][C][Ring2][Ring1][=Branch1][=O][C][=C][Ring2][Ring1][=N] |
c1ccc(COC2CCCN(Cc3nc(-c4cnccn4)no3)C2)cc1 | [C][=C][C][=C][Branch2][Ring1][P][C][O][C][C][C][C][N][Branch2][Ring1][Ring1][C][C][=N][C][Branch1][=Branch2][C][=C][N][=C][C][=N][Ring1][=Branch1][=N][O][Ring1][O][C][Ring2][Ring1][C][C][=C][Ring2][Ring1][#Branch2] |
CN(C)C(=O)c1cc2[nH]c(=O)c3cnc(C4CCCCC4)n3c2cc1Cl | [C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][NH1][C][=Branch1][C][=O][C][=C][N][=C][Branch1][=Branch2][C][C][C][C][C][C][Ring1][=Branch1][N][Ring1][O][C][=Ring1][S][C][=C][Ring2][Ring1][Ring2][Cl] |
Oc1ccccc1-c1nn(-c2ccccc2)cc1-c1nn[nH]n1 | [O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=N][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][O][C][N][=N][NH1][N][=Ring1][Branch1] |
COc1c(O)cc2oc3cc(O)c(CC=C(C)C)c(OC)c3c(=O)c2c1CC=C(C)C | [C][O][C][=C][Branch1][C][O][C][=C][O][C][=C][C][Branch1][C][O][=C][Branch1][Branch2][C][C][=C][Branch1][C][C][C][C][Branch1][Ring1][O][C][=C][Ring1][=C][C][=Branch1][C][=O][C][Ring2][Ring1][Ring1][=C][Ring2][Ring1][Branch2][C][C][=C][Branch1][C][C][C] |
CCN(Cc1ccc(C#CCCO)cc1)CC1CCCN(CCc2cccc(F)c2)C1 | [C][C][N][Branch1][P][C][C][=C][C][=C][Branch1][=Branch1][C][#C][C][C][O][C][=C][Ring1][O][C][C][C][C][C][N][Branch1][=C][C][C][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][Ring1][#C] |
CCCCCCCCC=CCCCCCCCCOc1ccc(C(=O)OC)cc1 | [C][C][C][C][C][C][C][C][C][=C][C][C][C][C][C][C][C][C][O][C][=C][C][=C][Branch1][#Branch1][C][=Branch1][C][=O][O][C][C][=C][Ring1][#Branch2] |
COc1ccc(OC)c(C2CCN(C(=O)C3CCS(=O)(=O)CC3)C2)c1 | [C][O][C][=C][C][=C][Branch1][Ring1][O][C][C][Branch2][Ring1][=N][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][Ring1][Branch2][C][Ring1][#C][=C][Ring2][Ring1][#Branch1] |
CCCCCN(C(CO)CCC(F)(F)CNC(=O)C(NC(=O)OC)C(c1ccccc1)c1ccccc1)S(=O)(=O)c1ccc(CO)cc1 | [C][C][C][C][C][N][Branch2][Branch1][C][C][Branch1][Ring1][C][O][C][C][C][Branch1][C][F][Branch1][C][F][C][N][C][=Branch1][C][=O][C][Branch1][Branch2][N][C][=Branch1][C][=O][O][C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring1][C][O][C][=C][Ring1][Branch2] |
O=[N+]([O-])c1cn2c(n1)OCC(OCc1ccc(N3CCCCC3)nc1)C2 | [O][=N+1][Branch1][C][O-1][C][=C][N][C][=Branch1][Ring2][=N][Ring1][Branch1][O][C][C][Branch2][Ring1][Branch1][O][C][C][=C][C][=C][Branch1][=Branch2][N][C][C][C][C][C][Ring1][=Branch1][N][=C][Ring1][N][C][Ring2][Ring1][Branch1] |
CC(C)CC(O)C(O)C(CC1CCCCC1)NC(=O)C(Cc1cscn1)NC(=O)C(CC(=O)CN1CCOCC1)Cc1ccccc1 | [C][C][Branch1][C][C][C][C][Branch1][C][O][C][Branch1][C][O][C][Branch1][#Branch2][C][C][C][C][C][C][C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][Branch1][=Branch2][C][C][=C][S][C][=N][Ring1][Branch1][N][C][=Branch1][C][=O][C][Branch1][#C][C][C][=Branch1][C][=O][C][N][C][C][O][C][C][Ring1][=Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] |
C#CCNCCC(=O)Nc1ccc2cc3ccc(NC(C)=O)cc3nc2c1 | [C][#C][C][N][C][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][C][=C][C][Branch1][#Branch1][N][C][Branch1][C][C][=O][=C][C][Ring1][#Branch2][=N][C][Ring1][=C][=C][Ring2][Ring1][C] |
O=C(O)c1nc(N2CCc3cccc(C(O)=Nc4nc5ccccc5s4)c3C2)ccc1-c1cnn(CC2CCOCC2)c1 | [O][=C][Branch1][C][O][C][=N][C][Branch2][Ring2][=Branch1][N][C][C][C][=C][C][=C][C][Branch2][Ring1][Ring1][C][Branch1][C][O][=N][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][S][Ring1][=Branch2][=C][Ring2][Ring1][C][C][Ring2][Ring1][=Branch1][=C][C][=C][Ring2][Ring1][N][C][C][=N][N][Branch1][#Branch2][C][C][C][C][O][C][C][Ring1][=Branch1][C][=Ring1][N] |
Oc1c(Cl)cc(Cl)cc1C1Nc2ccccc2-n2cccc21 | [O][C][=C][Branch1][C][Cl][C][=C][Branch1][C][Cl][C][=C][Ring1][Branch2][C][N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=C][C][=C][Ring1][Branch1][Ring1][=N] |
CSc1cccc(N(CC2CCCN2)C(=O)C(C)Oc2ccccc2)c1 | [C][S][C][=C][C][=C][C][Branch2][Ring1][=N][N][Branch1][=Branch2][C][C][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][Branch1][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring2][Ring1][Branch2] |
CC12OOC(O1)C1OC2(C)C2CCCCC1C2=O | [C][C][O][O][C][Branch1][Ring2][O][Ring1][Branch1][C][O][C][Ring1][Branch2][Branch1][C][C][C][C][C][C][C][C][Ring1][#Branch2][C][Ring1][#Branch1][=O] |
N#Cc1ccc(CS(=O)(=O)NCCc2c(CCOc3ccc(C(=O)O)cc3)c3cc(Cl)ccc3n2C(c2ccccc2)c2ccccc2)cc1 | [N][#C][C][=C][C][=C][Branch2][=Branch1][Branch1][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][=C][Branch2][Ring1][Ring1][C][C][O][C][=C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][=Branch2][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][N][Ring2][Ring1][=Branch1][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring2][S] |
CN(CCC(=O)Nc1ccc2c(c1)OCO2)Cc1ccccc1 | [C][N][Branch2][Ring1][#Branch1][C][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1] |
CC1COC2(CC1OC(=O)c1ccc(O)cc1)OC1CC(C(=O)OC3OC(CO)C(O)C(O)C3OC3OC(CO)C(O)C(O)C3O)CC(O)C1(O)C2=O | [C][C][C][O][C][Branch2][Ring1][Branch1][C][C][Ring1][=Branch1][O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][O][C][C][C][Branch2][Ring2][N][C][=Branch1][C][=O][O][C][O][C][Branch1][Ring1][C][O][C][Branch1][C][O][C][Branch1][C][O][C][Ring1][#Branch2][O][C][O][C][Branch1][Ring1][C][O][C][Branch1][C][O][C][Branch1][C][O][C][Ring1][#Branch2][O][C][C][Branch1][C][O][C][Ring2][Ring1][S][Branch1][C][O][C][Ring2][Ring2][S][=O] |
CC(C)Oc1ccc(-c2nnc(C3=S=C(C4(C)CS(=O)(=O)N(C)C(=N)N4)C(Cl)=C3)o2)cc1 | [C][C][Branch1][C][C][O][C][=C][C][=C][Branch2][Ring2][S][C][=N][N][=C][Branch2][Ring2][Branch1][C][=S][=C][Branch2][Ring1][Branch2][C][Branch1][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][Branch1][C][C][C][=Branch1][C][=N][N][Ring1][O][C][Branch1][C][Cl][=C][Ring1][P][O][Ring2][Ring1][=Branch1][C][=C][Ring2][Ring1][N] |
OC1CN(c2nccnc2OC2CN(c3ccc4ccccc4n3)C2)C1 | [O][C][C][N][Branch2][Ring1][S][C][=N][C][=C][N][=C][Ring1][=Branch1][O][C][C][N][Branch1][#C][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=N][Ring1][#Branch2][C][Ring1][=C][C][Ring2][Ring1][=Branch2] |
COc1ccc(-n2c(C)nnc2-c2csc(N)n2)c(OC)c1 | [C][O][C][=C][C][=C][Branch2][Ring1][Branch1][N][C][Branch1][C][C][=N][N][=C][Ring1][=Branch1][C][=C][S][C][Branch1][C][N][=N][Ring1][=Branch1][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][Ring2] |
CON=c1ssc(-c2cc(OC)c(OC)c(OC)c2)c1-c1ccc(OC)c([N+](=O)[O-])c1 | [C][O][N][=C][S][S][C][Branch2][Ring1][Branch1][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][Ring1][N][=C][Ring1][P][C][=C][C][=C][Branch1][Ring1][O][C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][O] |
CCCCCN(CCCCC)c1nc(N(CCO)CCO)nc2c(N(CCCCC)CCCCC)nc(N(CCO)CCO)nc12 | [C][C][C][C][C][N][Branch1][=Branch1][C][C][C][C][C][C][=N][C][Branch1][#Branch2][N][Branch1][Ring2][C][C][O][C][C][O][=N][C][=C][Branch1][=C][N][Branch1][=Branch1][C][C][C][C][C][C][C][C][C][C][N][=C][Branch1][#Branch2][N][Branch1][Ring2][C][C][O][C][C][O][N][=C][Ring2][Ring2][Ring1][Ring2][Ring1][Branch2] |
Cc1nc2cc(-n3cnc4cc(-c5ccc(Cl)cc5)sc4c3=O)ccc2n1C1CCCCC1 | [C][C][=N][C][=C][C][Branch2][Ring1][N][N][C][=N][C][C][=C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][S][C][=Ring1][N][C][Ring1][S][=O][=C][C][=C][Ring2][Ring1][#Branch1][N][Ring2][Ring1][#Branch2][C][C][C][C][C][C][Ring1][=Branch1] |
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