ID large_stringlengths 1 7 | smiles stringlengths 15 57 | selfies stringlengths 55 294 | safe stringlengths 15 83 |
|---|---|---|---|
28004 | COc1ccccc1-n1nnnc1SCC(=O)Nc1ccccc1 | [C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][N][=N][N][=C][Ring1][Branch1][S][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1] | c13ccccc16.n16nnnc17.c15ccccc1.C4C2=O.CO3.S47.N25 |
28005 | O=C(CSc1nnc(-c2cccnc2)o1)OC1CCCCC1 | [O][=C][Branch2][Ring1][Ring2][C][S][C][=N][N][=C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][O][Ring1][O][O][C][C][C][C][C][C][Ring1][=Branch1] | c16nnc7o1.c17cccnc1.C14CCCCC1.O=C3C5.S56.O34 |
28006 | COc1ccc(C(=O)CSc2nnc(-c3cccnc3)o2)cc1 | [C][O][C][=C][C][=C][Branch2][Ring1][Branch2][C][=Branch1][C][=O][C][S][C][=N][N][=C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][O][Ring1][O][C][=C][Ring2][Ring1][Branch1] | c14ccc6cc1.c17nnc8o1.c18cccnc1.C6(=O)C5.CO4.S57 |
28007 | Cc1cccc(NC(=O)CSc2nnc(-c3cccnc3)n2C)c1 | [C][C][=C][C][=C][C][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][C][S][C][=N][N][=C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][N][Ring1][O][C][=C][Ring2][Ring1][#Branch1] | Cc1cccc6c1.c17nnc8n1C.c18cccnc1.C4(=O)C5.N46.S57 |
28008 | Cn1c(SCc2ccccc2)nnc1-c1cccnc1 | [C][N][C][Branch1][O][S][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][N][=C][Ring1][=N][C][=C][C][=C][N][=C][Ring1][=Branch1] | Cn1c5nnc16.c14ccccc1.c16cccnc1.S35.C34 |
28009 | CC(Sc1nnc(-c2cccnc2)n1C)C(=O)Nc1ccccc1 | [C][C][Branch2][Ring1][Ring2][S][C][=N][N][=C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][N][Ring1][O][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1] | c16nnc7n1C.c17cccnc1.c15ccccc1.CC4C3=O.S46.N35 |
28010 | Cn1c(SCC(=O)OC2CCCCC2)nnc1-c1cccnc1 | [C][N][C][Branch1][S][S][C][C][=Branch1][C][=O][O][C][C][C][C][C][C][Ring1][=Branch1][=N][N][=C][Ring1][S][C][=C][C][=C][N][=C][Ring1][=Branch1] | Cn1c6nnc17.C14CCCCC1.c17cccnc1.C5C3=O.S56.O34 |
28011 | COC(=O)CSc1nnc(-c2ccc(O)cc2)n1-c1ccccc1 | [C][O][C][=Branch1][C][=O][C][S][C][=N][N][=C][Branch1][N][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][N][Ring1][N][C][=C][C][=C][C][=C][Ring1][=Branch1] | c16nnc7n15.c17ccc(O)cc1.c15ccccc1.C3(=O)C4.CO3.S46 |
28012 | CCOC(=O)CSc1nnc(-c2ccc(O)cc2)n1CC | [C][C][O][C][=Branch1][C][=O][C][S][C][=N][N][=C][Branch1][N][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][N][Ring1][N][C][C] | c17nnc8n16.c18ccc(O)cc1.C3(=O)C5.CC4.O34.S57.C6C |
28013 | CCn1c(SCC(=O)OC)nnc1-c1ccc(O)cc1 | [C][C][N][C][Branch1][=Branch2][S][C][C][=Branch1][C][=O][O][C][=N][N][=C][Ring1][O][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1] | n14c5nnc16.c16ccc(O)cc1.C3C2=O.CC4.S35.O2C |
28014 | Cc1sc2ncnc(SCC(=O)N3CCCCC3C)c2c1C | [C][C][S][C][=N][C][=N][C][Branch1][S][S][C][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][=Branch1][C][=C][Ring1][P][C][=Ring2][Ring1][Ring2][C] | Cc1sc2ncnc6c2c1C.N14CCCCC1C.C5C4=O.S56 |
28015 | Cc1sc2ncnc(SCC(=O)N3CCCC(C)C3)c2c1C | [C][C][S][C][=N][C][=N][C][Branch2][Ring1][C][S][C][C][=Branch1][C][=O][N][C][C][C][C][Branch1][C][C][C][Ring1][#Branch1][=C][Ring1][P][C][=Ring2][Ring1][Ring2][C] | Cc1sc2ncnc6c2c1C.N14CCCC(C)C1.C5C4=O.S56 |
28016 | CCN(CC)C(=O)CSc1ncnc2sc(C)c(C)c12 | [C][C][N][Branch1][Ring1][C][C][C][=Branch1][C][=O][C][S][C][=N][C][=N][C][S][C][Branch1][C][C][=C][Branch1][C][C][C][Ring1][O][=Ring1][#Branch1] | c17ncnc2sc(C)c(C)c12.C3(=O)C6.N345.CC4.C5C.S67 |
28017 | COC(=O)CSc1nnc(-c2ccncc2)n1-c1ccccc1 | [C][O][C][=Branch1][C][=O][C][S][C][=N][N][=C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][N][Ring1][O][C][=C][C][=C][C][=C][Ring1][=Branch1] | c16nnc7n15.c17ccncc1.c15ccccc1.C3(=O)C4.CO3.S46 |
28018 | NC(=O)CSc1nnc(-c2ccncc2)n1-c1ccccc1 | [N][C][=Branch1][C][=O][C][S][C][=N][N][=C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][N][Ring1][O][C][=C][C][=C][C][=C][Ring1][=Branch1] | c15nnc6n14.c16ccncc1.c14ccccc1.NC(=O)C3.S35 |
28019 | Cc1cccc(NC(=O)CSc2nnc(-c3ccncc3)n2C)c1 | [C][C][=C][C][=C][C][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][C][S][C][=N][N][=C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][N][Ring1][O][C][=C][Ring2][Ring1][#Branch1] | Cc1cccc6c1.c17nnc8n1C.c18ccncc1.C4(=O)C5.N46.S57 |
28020 | Cc1ccc(NC(=O)CSc2nnc(-c3ccncc3)n2C)cc1 | [C][C][=C][C][=C][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][C][S][C][=N][N][=C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][N][Ring1][O][C][C][=C][Ring2][Ring1][#Branch1] | Cc1ccc6cc1.c17nnc8n1C.c18ccncc1.C4(=O)C5.N46.S57 |
28021 | Cn1c(SCC(=O)Nc2ccccc2)nnc1-c1ccncc1 | [C][N][C][Branch1][S][S][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][N][=C][Ring1][S][C][=C][C][=N][C][=C][Ring1][=Branch1] | Cn1c6nnc17.c15ccccc1.c17ccncc1.C4C3=O.S46.N35 |
28022 | Cn1c(SCC(=O)Nc2ccc(F)cc2)nnc1-c1ccncc1 | [C][N][C][Branch2][Ring1][Ring1][S][C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][=N][N][=C][Ring1][P][C][=C][C][=N][C][=C][Ring1][=Branch1] | Cn1c6nnc17.c15ccc(F)cc1.c17ccncc1.C4C3=O.S46.N35 |
28023 | Cc1cnc(NC(=O)CSc2nnc(-c3ccncc3)n2C)s1 | [C][C][=C][N][=C][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][C][S][C][=N][N][=C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][N][Ring1][O][C][S][Ring2][Ring1][=Branch1] | c17nnc8n1C.Cc1cnc6s1.c18ccncc1.C4(=O)C5.N46.S57 |
28024 | Cc1ccc(C(=O)CSc2nnc(-c3ccncc3)n2C)cc1 | [C][C][=C][C][=C][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][C][S][C][=N][N][=C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][N][Ring1][O][C][C][=C][Ring2][Ring1][=Branch1] | Cc1ccc5cc1.c16nnc7n1C.c17ccncc1.C5(=O)C4.S46 |
28025 | COc1ccc(C(=O)CSc2nnc(-c3ccncc3)n2C)cc1 | [C][O][C][=C][C][=C][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][C][S][C][=N][N][=C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][N][Ring1][O][C][C][=C][Ring2][Ring1][=Branch1] | c14ccc6cc1.c17nnc8n1C.c18ccncc1.C6(=O)C5.CO4.S57 |
28026 | Cc1ccc(CSc2nnc(-c3ccncc3)n2C)cc1 | [C][C][=C][C][=C][Branch2][Ring1][Branch1][C][S][C][=N][N][=C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][N][Ring1][O][C][C][=C][Ring2][Ring1][Ring2] | Cc1ccc5cc1.c16nnc7n1C.c17ccncc1.C45.S46 |
28028 | Cn1c(SCc2ccc(Cl)cc2)nnc1-c1ccncc1 | [C][N][C][Branch1][=C][S][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][=N][N][=C][Ring1][=C][C][=C][C][=N][C][=C][Ring1][=Branch1] | Cn1c5nnc16.c14ccc(Cl)cc1.c16ccncc1.S35.C34 |
28029 | Cn1c(SCC(=O)N2CCCCC2)nnc1-c1ccncc1 | [C][N][C][Branch1][#C][S][C][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][=Branch1][=N][N][=C][Ring1][#C][C][=C][C][=N][C][=C][Ring1][=Branch1] | Cn1c5nnc16.N13CCCCC1.c16ccncc1.C4C3=O.S45 |
28030 | Cc1ccc(-n2c(SCC(N)=O)nnc2-c2ccncc2)cc1 | [C][C][=C][C][=C][Branch2][Ring1][=Branch2][N][C][Branch1][Branch2][S][C][C][Branch1][C][N][=O][=N][N][=C][Ring1][#Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][=Branch1] | Cc1ccc4cc1.n14c5nnc16.c16ccncc1.C3C(N)=O.S35 |
28031 | CCOc1ccc(-c2nnc(-c3ccncc3)o2)cc1 | [C][C][O][C][=C][C][=C][Branch2][Ring1][C][C][=N][N][=C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][O][Ring1][O][C][=C][Ring1][P] | c15ccc6cc1.c16nnc7o1.c17ccncc1.CC4.O45 |
28032 | Cc1cc(C)c(C#N)c(SCC(=O)Nc2c(C)cccc2C)n1 | [C][C][=C][C][Branch1][C][C][=C][Branch1][Ring1][C][#N][C][Branch2][Ring1][Ring2][S][C][C][=Branch1][C][=O][N][C][=C][Branch1][C][C][C][=C][C][=C][Ring1][#Branch1][C][=N][Ring2][Ring1][=Branch1] | Cc1cc(C)c(C#N)c6n1.c15c(C)cccc1C.C4C3=O.S46.N35 |
28033 | CCc1cccc(C)c1NC(=O)CSc1nc(C)cc(C)c1C#N | [C][C][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C][S][C][=N][C][Branch1][C][C][=C][C][Branch1][C][C][=C][Ring1][Branch2][C][#N] | c16nc(C)cc(C)c1C#N.c15cccc(C)c14.C2(=O)C3.CC5.N24.S36 |
28035 | Cc1cc(C)c(C#N)c(SCC(=O)N2CCC(C)CC2)n1 | [C][C][=C][C][Branch1][C][C][=C][Branch1][Ring1][C][#N][C][Branch2][Ring1][C][S][C][C][=Branch1][C][=O][N][C][C][C][Branch1][C][C][C][C][Ring1][#Branch1][=N][Ring2][Ring1][Ring2] | Cc1cc(C)c(C#N)c5n1.N13CCC(C)CC1.C4C3=O.S45 |
28036 | Cc1cc(C)c(C#N)c(SCC(=O)N2CCCC(C)C2)n1 | [C][C][=C][C][Branch1][C][C][=C][Branch1][Ring1][C][#N][C][Branch2][Ring1][C][S][C][C][=Branch1][C][=O][N][C][C][C][C][Branch1][C][C][C][Ring1][#Branch1][=N][Ring2][Ring1][Ring2] | Cc1cc(C)c(C#N)c5n1.N13CCCC(C)C1.C4C3=O.S45 |
28037 | Cc1cc(C)c(C#N)c(SCC(=O)N2CCCCC2C)n1 | [C][C][=C][C][Branch1][C][C][=C][Branch1][Ring1][C][#N][C][Branch1][S][S][C][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][=Branch1][C][=N][Ring2][Ring1][Ring2] | Cc1cc(C)c(C#N)c5n1.N13CCCCC1C.C4C3=O.S45 |
28038 | Cc1cc(C)c(C#N)c(SCC(=O)N2C(C)CCCC2C)n1 | [C][C][=C][C][Branch1][C][C][=C][Branch1][Ring1][C][#N][C][Branch2][Ring1][Ring1][S][C][C][=Branch1][C][=O][N][C][Branch1][C][C][C][C][C][C][Ring1][#Branch1][C][=N][Ring2][Ring1][Branch1] | Cc1cc(C)c(C#N)c5n1.N13C(C)CCCC1C.C4C3=O.S45 |
28040 | Cc1cc(C)c2c(N)c(C(=O)Nc3c(C)cccc3C)sc2n1 | [C][C][=C][C][Branch1][C][C][=C][C][Branch1][C][N][=C][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][=C][Branch1][C][C][C][=C][C][=C][Ring1][#Branch1][C][S][C][Ring1][P][=N][Ring2][Ring1][=Branch1] | Cc1cc(C)c2c(N)c6sc2n1.c15c(C)cccc1C.C46=O.N45 |
28041 | CCN(CC)C(=O)CSc1ncnc2sc3c(c12)CCCC3 | [C][C][N][Branch1][Ring1][C][C][C][=Branch1][C][=O][C][S][C][=N][C][=N][C][S][C][=C][Branch1][=Branch1][C][Ring1][=Branch2][=Ring1][Branch1][C][C][C][C][Ring1][#Branch1] | c18ncnc2sc3c(c12)CCCC3.C4(=O)C7.N456.CC5.C6C.S78 |
28042 | COc1ccc(C(=O)CSc2nnc(-c3ccccc3O)o2)cc1 | [C][O][C][=C][C][=C][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][C][S][C][=N][N][=C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][O][Ring1][N][C][=C][Ring2][Ring1][=Branch1] | c14ccc6cc1.c18ccccc1O.c17nnc8o1.C6(=O)C5.CO4.S57 |
28043 | CCOC(=O)CSc1nnc(-c2ccc(Cl)cc2)n1C | [C][C][O][C][=Branch1][C][=O][C][S][C][=N][N][=C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][N][Ring1][N][C] | c16nnc7n1C.c17ccc(Cl)cc1.C3(=O)C5.CC4.O34.S56 |
28044 | COC(=O)CSc1nnc(-c2ccc(Cl)cc2)n1C | [C][O][C][=Branch1][C][=O][C][S][C][=N][N][=C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][N][Ring1][N][C] | c15nnc6n1C.c16ccc(Cl)cc1.C3(=O)C4.CO3.S45 |
28045 | Cn1c(SCC(N)=O)nnc1-c1ccc(Cl)cc1 | [C][N][C][Branch1][Branch2][S][C][C][Branch1][C][N][=O][=N][N][=C][Ring1][#Branch2][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1] | Cn1c3nnc14.c14ccc(Cl)cc1.C2C(N)=O.S23 |
28046 | Cc1cc(C)c(C#N)c(SCC(=O)c2ccco2)n1 | [C][C][=C][C][Branch1][C][C][=C][Branch1][Ring1][C][#N][C][Branch1][=C][S][C][C][=Branch1][C][=O][C][=C][C][=C][O][Ring1][Branch1][=N][Ring2][Ring1][C] | Cc1cc(C)c(C#N)c5n1.c14ccco1.C3C4=O.S35 |
28047 | O=C(Cn1nnc(-c2ccccc2)n1)N1CCCCC1 | [O][=C][Branch2][Ring1][Ring1][C][N][N][=N][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][Ring1][O][N][C][C][C][C][C][Ring1][=Branch1] | n14nnc5n1.c15ccccc1.N13CCCCC1.O=C3C4 |
28048 | CCOC(=O)CSc1nnc(-c2ccccc2C)n1C | [C][C][O][C][=Branch1][C][=O][C][S][C][=N][N][=C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][Ring1][N][C] | c16nnc7n1C.c17ccccc1C.C3(=O)C5.CC4.O34.S56 |
28049 | Cc1ccccc1-c1nnc(SCC(N)=O)n1C | [C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=N][N][=C][Branch1][Branch2][S][C][C][Branch1][C][N][=O][N][Ring1][#Branch2][C] | Cc1ccccc14.c14nnc3n1C.C2C(N)=O.S23 |
28050 | Cn1c(Cc2ccccc2)nnc1SCC(=O)N1CCOCC1 | [C][N][C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][N][=C][Ring1][N][S][C][C][=Branch1][C][=O][N][C][C][O][C][C][Ring1][=Branch1] | Cn1c5nnc17.c16ccccc1.N13CCOCC1.C4C3=O.C56.S47 |
28051 | O=C(CCn1c(=O)[nH]c2ccsc2c1=O)Nc1ccc(F)cc1 | [O][=C][Branch2][Ring1][Ring2][C][C][N][C][=Branch1][C][=O][NH1][C][C][=C][S][C][=Ring1][Branch1][C][Ring1][#Branch2][=O][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1] | n15c(=O)[nH]c2ccsc2c1=O.c14ccc(F)cc1.O=C3CC5.N34 |
28052 | O=C(NCc1cccnc1)c1ccc2nc3ccccc3c(=O)n2c1 | [O][=C][Branch1][O][N][C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][C][=C][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Ring1][O][C][=Ring1][#C] | c16ccc2nc3ccccc3c(=O)n2c1.c17cccnc1.O=C46.N45.C57 |
28053 | O=C(NCCc1ccccc1)c1ccc2nc3ccccc3c(=O)n2c1 | [O][=C][Branch1][N][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][=C][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Ring1][O][C][=Ring1][#C] | c16ccc2nc3ccccc3c(=O)n2c1.c17ccccc1.O=C46.C5C7.N45 |
28054 | CN(Cc1ccccc1)C(=O)c1ccc2nc3ccccc3c(=O)n2c1 | [C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][C][=C][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Ring1][O][C][=Ring1][#C] | c16ccc2nc3ccccc3c(=O)n2c1.c17ccccc1.CN45.C46=O.C57 |
28055 | C=CCn1c(=O)[nH]c2cc(C(=O)NCc3ccco3)ccc2c1=O | [C][=C][C][N][C][=Branch1][C][=O][NH1][C][=C][C][Branch1][=C][C][=Branch1][C][=O][N][C][C][=C][C][=C][O][Ring1][Branch1][=C][C][=C][Ring1][#C][C][Ring2][Ring1][Ring2][=O] | n17c(=O)[nH]c2cc6ccc2c1=O.c18ccco1.C=CC7.C46=O.N45.C58 |
28056 | Cc1ccc(N2C(=O)NC3CC2(C)Oc2ccccc23)cc1 | [C][C][=C][C][=C][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][N][C][C][C][Ring1][#Branch1][Branch1][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][O][C][=C][Ring2][Ring1][Branch1] | N14C(=O)NC2CC1(C)Oc1ccccc12.Cc1ccc4cc1 |
28057 | CC12CC(NC(=O)N1c1cccc(Cl)c1)c1ccccc1O2 | [C][C][C][C][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][N][Ring1][#Branch1][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring2][Ring1][Branch1] | CC12CC(NC(=O)N13)c1ccccc1O2.c13cccc(Cl)c1 |
28058 | CC12CC(NC(=O)N1c1ccc(Cl)cc1)c1ccccc1O2 | [C][C][C][C][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][N][Ring1][#Branch1][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring2][Ring1][Branch1] | CC12CC(NC(=O)N13)c1ccccc1O2.c13ccc(Cl)cc1 |
28059 | COc1cccc2c1OC1(C)CC2NC(=O)N1c1cccc(C)c1 | [C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][C][C][C][Ring1][#Branch1][N][C][=Branch1][C][=O][N][Ring1][Branch2][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1] | c13cccc2c1OC1(C)CC2NC(=O)N14.c14cccc(C)c1.CO3 |
28060 | COc1cccc2c1OC1(C)CC2NC(=O)N1c1ccc(C)cc1 | [C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][C][C][C][Ring1][#Branch1][N][C][=Branch1][C][=O][N][Ring1][Branch2][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1] | c13cccc2c1OC1(C)CC2NC(=O)N14.c14ccc(C)cc1.CO3 |
28061 | COc1cccc2c1OC1(C)CC2NC(=O)N1c1cccc(Cl)c1 | [C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][C][C][C][Ring1][#Branch1][N][C][=Branch1][C][=O][N][Ring1][Branch2][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1] | c13cccc2c1OC1(C)CC2NC(=O)N14.c14cccc(Cl)c1.CO3 |
28062 | COc1cccc2c1OC1(C)CC2NC(=O)N1c1ccc(Cl)cc1 | [C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][C][C][C][Ring1][#Branch1][N][C][=Branch1][C][=O][N][Ring1][Branch2][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1] | c13cccc2c1OC1(C)CC2NC(=O)N14.c14ccc(Cl)cc1.CO3 |
28064 | COc1cccc(N2C(=O)NC3CC2(C)Oc2ccccc23)c1 | [C][O][C][=C][C][=C][C][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][N][C][C][C][Ring1][#Branch1][Branch1][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][O][=C][Ring2][Ring1][Branch1] | N15C(=O)NC2CC1(C)Oc1ccccc12.c14cccc5c1.CO4 |
28065 | CC12CC(NC(=O)N1Cc1ccccc1)c1ccccc1O2 | [C][C][C][C][Branch2][Ring1][C][N][C][=Branch1][C][=O][N][Ring1][#Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring2][Ring1][Branch1] | CC12CC(NC(=O)N13)c1ccccc1O2.c14ccccc1.C34 |
28066 | CC12CC(NC(=O)N1c1ccc(F)cc1)c1ccccc1O2 | [C][C][C][C][Branch2][Ring1][Ring2][N][C][=Branch1][C][=O][N][Ring1][#Branch1][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring2][Ring1][Branch1] | CC12CC(NC(=O)N13)c1ccccc1O2.c13ccc(F)cc1 |
28067 | CSc1cccc(N2C(=O)NC3CC2(C)Oc2ccccc23)c1 | [C][S][C][=C][C][=C][C][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][N][C][C][C][Ring1][#Branch1][Branch1][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][O][=C][Ring2][Ring1][Branch1] | N14C(=O)NC2CC1(C)Oc1ccccc12.c15cccc4c1.CS5 |
28068 | COc1cccc2c1OC1(C)CC2NC(=O)N1c1ccc(F)cc1 | [C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][Branch1][C][C][C][C][Ring1][#Branch1][N][C][=Branch1][C][=O][N][Ring1][Branch2][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1] | c13cccc2c1OC1(C)CC2NC(=O)N14.c14ccc(F)cc1.CO3 |
28070 | O=C(Cn1c(=O)[nH]c2ccsc2c1=O)NCCc1ccccc1 | [O][=C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][NH1][C][C][=C][S][C][=Ring1][Branch1][C][Ring1][#Branch2][=O][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1] | n15c(=O)[nH]c2ccsc2c1=O.c16ccccc1.O=C3C5.C4C6.N34 |
28071 | Cc1ccc(CNC(=O)Cn2c(=O)[nH]c3ccsc3c2=O)cc1 | [C][C][=C][C][=C][Branch2][Ring1][=Branch2][C][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][NH1][C][C][=C][S][C][=Ring1][Branch1][C][Ring1][#Branch2][=O][C][=C][Ring2][Ring1][=Branch1] | n16c(=O)[nH]c2ccsc2c1=O.Cc1ccc7cc1.C4(=O)C6.C57.N45 |
28072 | O=c1c2sccc2n(Cc2ccccc2)c(=O)n1-c1ccccc1 | [O][=C][C][S][C][=C][C][=Ring1][Branch1][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Ring1][P][C][=C][C][=C][C][=C][Ring1][=Branch1] | O=c1c2sccc2n3c(=O)n15.c14ccccc1.c15ccccc1.C34 |
28073 | O=C(Cn1c(=O)[nH]c2ccsc2c1=O)NC1CCCCC1 | [O][=C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][NH1][C][C][=C][S][C][=Ring1][Branch1][C][Ring1][#Branch2][=O][N][C][C][C][C][C][C][Ring1][=Branch1] | n15c(=O)[nH]c2ccsc2c1=O.C14CCCCC1.O=C3C5.N34 |
28074 | O=C(Cn1c(=O)[nH]c2ccsc2c1=O)NCc1ccc(F)cc1 | [O][=C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][NH1][C][C][=C][S][C][=Ring1][Branch1][C][Ring1][#Branch2][=O][N][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1] | n15c(=O)[nH]c2ccsc2c1=O.c16ccc(F)cc1.O=C3C5.N34.C46 |
28076 | COc1ccc(CNC(=O)Cn2c(=O)[nH]c3ccsc3c2=O)cc1 | [C][O][C][=C][C][=C][Branch2][Ring1][=Branch2][C][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][NH1][C][C][=C][S][C][=Ring1][Branch1][C][Ring1][#Branch2][=O][C][=C][Ring2][Ring1][=Branch1] | n17c(=O)[nH]c2ccsc2c1=O.c15ccc8cc1.C4(=O)C7.CO5.C68.N46 |
28077 | Cc1sc2[nH]c(=O)n(-c3ccc(F)cc3)c(=O)c2c1C | [C][C][S][C][NH1][C][=Branch1][C][=O][N][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][C][=Ring1][#C][C][=Ring2][Ring1][C][C] | Cc1sc2[nH]c(=O)n4c(=O)c2c1C.c14ccc(F)cc1 |
28078 | Cc1ccc(-n2c(=O)[nH]c3sc(C)c(C)c3c2=O)cc1C | [C][C][=C][C][=C][Branch2][Ring1][Branch2][N][C][=Branch1][C][=O][NH1][C][S][C][Branch1][C][C][=C][Branch1][C][C][C][=Ring1][#Branch1][C][Ring1][N][=O][C][=C][Ring2][Ring1][Ring1][C] | n14c(=O)[nH]c2sc(C)c(C)c2c1=O.Cc1ccc4cc1C |
28079 | CCOc1ccc(-n2c(=O)[nH]c3sc4c(c3c2=O)CCCC4)cc1 | [C][C][O][C][=C][C][=C][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][NH1][C][S][C][=C][Branch1][Branch2][C][=Ring1][Branch1][C][Ring1][#Branch2][=O][C][C][C][C][Ring1][=Branch2][C][=C][Ring2][Ring1][Branch1] | n17c(=O)[nH]c2sc3c(c2c1=O)CCCC3.c16ccc7cc1.CC5.O56 |
28080 | CC1CCN(C(=O)c2cccn3c(=O)c4sccc4nc23)CC1 | [C][C][C][C][N][Branch2][Ring1][O][C][=Branch1][C][=O][C][=C][C][=C][N][C][=Branch1][C][=O][C][S][C][=C][C][=Ring1][Branch1][N][=C][Ring1][=C][Ring1][#Branch2][C][C][Ring2][Ring1][=Branch1] | c16cccn2c(=O)c3sccc3nc12.CC1CCN5CC1.C56=O |
28081 | COc1cc2[nH]c(=O)n(Cc3ccccc3)c(=O)c2cc1OC | [C][O][C][=C][C][NH1][C][=Branch1][C][=O][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][=Ring1][#C][C][=C][Ring2][Ring1][Ring1][O][C] | c14cc2[nH]c(=O)n6c(=O)c2cc15.c17ccccc1.CO4.C67.O5C |
28082 | O=C(NC1CC1)c1ccc2c(=O)n(-c3ccccc3)c(=O)[nH]c2c1 | [O][=C][Branch1][#Branch1][N][C][C][C][Ring1][Ring1][C][=C][C][=C][C][=Branch1][C][=O][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][NH1][C][Ring1][=C][=C][Ring2][Ring1][C] | c16ccc2c(=O)n7c(=O)[nH]c2c1.c17ccccc1.O=C46.C15CC1.N45 |
28083 | Cc1ccc(-n2c(=O)[nH]c3sc4c(c3c2=O)CCCC4)cc1 | [C][C][=C][C][=C][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][NH1][C][S][C][=C][Branch1][Branch2][C][=Ring1][Branch1][C][Ring1][#Branch2][=O][C][C][C][C][Ring1][=Branch2][C][=C][Ring2][Ring1][Branch1] | n15c(=O)[nH]c2sc3c(c2c1=O)CCCC3.Cc1ccc5cc1 |
28084 | CC(O)Cc1nsc(NC(=O)c2cccc(Cl)c2)n1 | [C][C][Branch1][C][O][C][C][=N][S][C][Branch1][P][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][=N][Ring1][#C] | c15cccc(Cl)c1.c16nsc4n1.CC(O)C6.C35=O.N34 |
28085 | COC(=O)c1nnn(CC(=O)Nc2ccc(C)cc2C)c1C(=O)OC | [C][O][C][=Branch1][C][=O][C][N][=N][N][Branch2][Ring1][Ring1][C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][C][C][=Ring1][P][C][=Branch1][C][=O][O][C] | c16ccc(C)cc1C.c17nnn9c18.C9C5=O.C37=O.C48=O.CO3.N56.O4C |
28087 | Cc1ccc2c(c1)N(CC(=O)NCCc1ccccc1)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][P][C][C][=Branch1][C][=O][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][O][Ring2][Ring1][Ring2] | Cc1ccc2c(c1)N(CC3=O)C(=O)CO2.c15ccccc1.C4C5.N34 |
28088 | Cc1ccc2c(c1)N(CC(=O)NCc1cccnc1)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][S][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][O][Ring2][Ring1][Ring1] | Cc1ccc2c(c1)N(CC3=O)C(=O)CO2.c15cccnc1.N34.C45 |
28089 | Cc1ccc2c(c1)N(CC(=O)NCc1ccccc1)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][S][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][O][Ring2][Ring1][Ring1] | Cc1ccc2c(c1)N(CC3=O)C(=O)CO2.c15ccccc1.N34.C45 |
28090 | Cc1ccc2c(c1)N(CC(=O)NCc1ccccc1Cl)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][P][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C][=Branch1][C][=O][C][O][Ring2][Ring1][Ring2] | Cc1ccc2c(c1)N(CC3=O)C(=O)CO2.c15ccccc1Cl.N34.C45 |
28091 | Cc1ccc2c(c1)N(CC(=O)NC1CCCCC1)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][#C][C][C][=Branch1][C][=O][N][C][C][C][C][C][C][Ring1][=Branch1][C][=Branch1][C][=O][C][O][Ring2][Ring1][C] | Cc1ccc2c(c1)N(CC3=O)C(=O)CO2.C14CCCCC1.N34 |
28092 | Cc1ccc2c(c1)N(CC(=O)NC1CCCC1)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][=C][C][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][Branch1][C][=Branch1][C][=O][C][O][Ring1][P] | Cc1ccc2c(c1)N(CC3=O)C(=O)CO2.C14CCCC1.N34 |
28093 | Cc1ccc2c(c1)N(CC(=O)NCc1ccco1)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][#C][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][O][Ring1][Branch1][C][=Branch1][C][=O][C][O][Ring2][Ring1][C] | Cc1ccc2c(c1)N(CC3=O)C(=O)CO2.c15ccco1.N34.C45 |
28095 | Cc1ccc2c(c1)N(CC(=O)NC(C)c1ccccc1)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch2][Ring1][Ring1][C][C][=Branch1][C][=O][N][C][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][O][Ring2][Ring1][Ring2] | Cc1ccc2c(c1)N(CC3=O)C(=O)CO2.c15ccccc1.C45C.N34 |
28096 | Cc1ccc2c(c1)N(CC(=O)NC1CC1)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][N][C][C][=Branch1][C][=O][N][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][C][O][Ring1][#C] | Cc1ccc2c(c1)N(CC3=O)C(=O)CO2.C14CC1.N34 |
28097 | Cc1ccc2c(c1)N(CC(=O)NCC1CCCO1)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][#C][C][C][=Branch1][C][=O][N][C][C][C][C][C][O][Ring1][Branch1][C][=Branch1][C][=O][C][O][Ring2][Ring1][C] | Cc1ccc2c(c1)N(CC3=O)C(=O)CO2.C15CCCO1.N34.C45 |
28098 | COc1ccccc1CNC(=O)CN1C(=O)COc2ccc(C)cc21 | [C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][O][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][Ring1][N] | C3(=O)CN1C(=O)COc2ccc(C)cc21.c14ccccc16.CO4.C56.N35 |
28099 | Cc1ccc2c(c1)N(CC(=O)NC1CCCCC1C)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][S][C][C][=Branch1][C][=O][N][C][C][C][C][C][C][Ring1][=Branch1][C][C][=Branch1][C][=O][C][O][Ring2][Ring1][Ring1] | Cc1ccc2c(c1)N(CC3=O)C(=O)CO2.C14CCCCC1C.N34 |
28100 | Cc1ccc2c(c1)N(CCC(=O)N1CCOCC1)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][#C][C][C][C][=Branch1][C][=O][N][C][C][O][C][C][Ring1][=Branch1][C][=Branch1][C][=O][C][O][Ring2][Ring1][C] | Cc1ccc2c(c1)N(CCC3=O)C(=O)CO2.N13CCOCC1 |
28101 | Cc1ccc2c(c1)N(CCC(=O)NCc1cccnc1)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][P][C][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][O][Ring2][Ring1][Ring2] | Cc1ccc2c(c1)N(CCC3=O)C(=O)CO2.c15cccnc1.N34.C45 |
28102 | Cc1ccc2c(c1)N(CCC(=O)NC1CCCCC1)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][S][C][C][C][=Branch1][C][=O][N][C][C][C][C][C][C][Ring1][=Branch1][C][=Branch1][C][=O][C][O][Ring2][Ring1][Ring1] | Cc1ccc2c(c1)N(CCC3=O)C(=O)CO2.C14CCCCC1.N34 |
28103 | Cc1ccc2c(c1)N(CCC(=O)NCc1ccco1)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][S][C][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][O][Ring1][Branch1][C][=Branch1][C][=O][C][O][Ring2][Ring1][Ring1] | Cc1ccc2c(c1)N(CCC3=O)C(=O)CO2.c15ccco1.N34.C45 |
28104 | Cc1ccc2c(c1)N(CCC(=O)NC1CCCCC1C)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][P][C][C][C][=Branch1][C][=O][N][C][C][C][C][C][C][Ring1][=Branch1][C][C][=Branch1][C][=O][C][O][Ring2][Ring1][Ring2] | Cc1ccc2c(c1)N(CCC3=O)C(=O)CO2.C14CCCCC1C.N34 |
28105 | Cc1ccc2c(c1)N(C(C)C(=O)NCCc1ccccc1)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch2][Ring1][Ring2][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][O][Ring2][Ring1][Branch1] | Cc1ccc2c(c1)N(C(C)C3=O)C(=O)CO2.c15ccccc1.C4C5.N34 |
28106 | Cc1ccc2c(c1)N(C(C)C(=O)NCc1ccccc1)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch2][Ring1][Ring1][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][O][Ring2][Ring1][Ring2] | Cc1ccc2c(c1)N(C(C)C3=O)C(=O)CO2.c15ccccc1.N34.C45 |
28107 | CCC(C)NC(=O)C(C)N1C(=O)COc2ccc(C)cc21 | [C][C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][Branch1][C][C][N][C][=Branch1][C][=O][C][O][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][Ring1][N] | C3(=O)C(C)N1C(=O)COc2ccc(C)cc21.CCC4C.N34 |
28108 | Cc1ccc2c(c1)N(C(C)C(=O)NC1CCCC1)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][P][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][Branch1][C][=Branch1][C][=O][C][O][Ring2][Ring1][C] | Cc1ccc2c(c1)N(C(C)C3=O)C(=O)CO2.C14CCCC1.N34 |
28109 | Cc1ccc(CNC(=O)C(C)N2C(=O)COc3ccc(C)cc32)cc1 | [C][C][=C][C][=C][Branch2][Ring1][#C][C][N][C][=Branch1][C][=O][C][Branch1][C][C][N][C][=Branch1][C][=O][C][O][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][Ring1][N][C][=C][Ring2][Ring1][Branch2] | C4(=O)C(C)N1C(=O)COc2ccc(C)cc21.Cc1ccc6cc1.C56.N45 |
28110 | Cc1ccc2c(c1)N(C(C)C(=O)NC1CC1)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][#C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][C][O][Ring1][S] | Cc1ccc2c(c1)N(C(C)C3=O)C(=O)CO2.C14CC1.N34 |
28111 | Cc1ccc2c(c1)N(C(C)C(=O)NCc1cccs1)C(=O)CO2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch2][Ring1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][S][Ring1][Branch1][C][=Branch1][C][=O][C][O][Ring2][Ring1][Ring1] | Cc1ccc2c(c1)N(C(C)C3=O)C(=O)CO2.c15cccs1.N34.C45 |
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