ID large_stringlengths 1 7 | smiles stringlengths 15 57 | selfies stringlengths 55 294 | safe stringlengths 15 83 |
|---|---|---|---|
1926022 | CCn1cc(CN2CC(C)N(C(=O)OC(C)(C)C)CC2C)cn1 | [C][C][N][C][=C][Branch2][Ring1][=N][C][N][C][C][Branch1][C][C][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][=C][C][C][=N][Ring2][Ring1][Branch1] | N16CC(C)N4CC1C.n17cc8cn1.C5(C)(C)C.C34=O.CC7.C68.O35 |
1926023 | CC(=O)N1CCN(Cc2ccc(F)cc2OC(F)(F)F)C(C)(C)C1 | [C][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][=Branch1][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][O][C][Branch1][C][F][Branch1][C][F][F][C][Branch1][C][C][Branch1][C][C][C][Ring2][Ring1][Branch1] | N13CCN5C(C)(C)C1.c16ccc(F)cc14.O4C(F)(F)F.CC3=O.C56 |
1926024 | CCOc1cccc(CN2CCOc3ccccc32)c1OC | [C][C][O][C][=C][C][=C][C][Branch1][S][C][N][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2][=C][Ring1][P][O][C] | N17CCOc2ccccc21.c15cccc8c16.CC4.O45.C78.O6C |
1926026 | CNC(=O)c1cccc(OCC2COC(c3ccc(Cl)cc3)O2)c1 | [C][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Ring1][#Branch1][O][C][C][C][O][C][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][O][Ring1][N][=C][Ring2][Ring1][Ring2] | c17cccc6c1.c19ccc(Cl)cc1.C18COC9O1.C47=O.CN4.O56.C58 |
1926027 | N#CC(NC(=O)Cc1cccc(O)c1)c1ccc(F)cc1F | [N][#C][C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][Branch1][C][O][=C][Ring1][#Branch1][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][F] | c14ccc(F)cc1F.c15cccc(O)c1.N#CC34.C2(=O)C5.N23 |
1926028 | COC(C(=O)NC(C)(C(N)=O)c1cccc(Cl)c1)c1ccccc1 | [C][O][C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][=Branch1][C][Branch1][C][N][=O][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1] | c16cccc(Cl)c1.C46(C)C(N)=O.c15ccccc1.C35C2=O.CO3.N24 |
1926029 | COC(=O)CCCC(=O)Nc1nc(-c2ccc(C)cc2C)cs1 | [C][O][C][=Branch1][C][=O][C][C][C][C][=Branch1][C][=O][N][C][=N][C][Branch1][=N][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][C][=C][S][Ring1][=N] | C3(=O)CCCC4=O.c16ccc(C)cc1C.c15nc6cs1.CO3.N45 |
1926030 | CC1CC(C(=O)N2CCC(CN3CCCCC3=O)CC2)CC(=O)N1 | [C][C][C][C][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][N][C][C][C][Branch1][O][C][N][C][C][C][C][C][Ring1][=Branch1][=O][C][C][Ring1][=C][C][C][=Branch1][C][=O][N][Ring2][Ring1][#Branch1] | CC1CC5CC(=O)N1.N14CCC7CC1.N16CCCCC1=O.C45=O.C67 |
1926031 | CN(CC(C)(CO)CO)C(=O)c1cc(F)cc2cccnc12 | [C][N][Branch1][N][C][C][Branch1][C][C][Branch1][Ring1][C][O][C][O][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][C][=C][C][=C][N][=C][Ring1][O][Ring1][=Branch1] | c15cc(F)cc2cccnc12.C4C(C)(CO)CO.CN34.C35=O |
1926032 | COC(C(=O)NC(c1nccc(C)n1)C1CC1)c1ccccc1 | [C][O][C][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][N][C][Branch1][N][C][=N][C][=C][C][Branch1][C][C][=N][Ring1][#Branch1][C][C][C][Ring1][Ring1][C][=C][C][=C][C][=C][Ring1][=Branch1] | c15nccc(C)n1.c17ccccc1.C37C2=O.C456.C16CC1.CO3.N24 |
1926033 | O=C(NCC(O)c1ccccc1F)Nc1nc2ccccn2n1 | [O][=C][Branch1][S][N][C][C][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][F][N][C][N][=C][C][=C][C][=C][N][Ring1][=Branch1][N][=Ring1][=Branch2] | c16nc2ccccn2n1.c17ccccc1F.C5C7O.O=C34.N35.N46 |
1926034 | O=C(NCC(O)c1ccccc1)Nc1nc2ccccn2n1 | [O][=C][Branch1][#C][N][C][C][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][N][=C][C][=C][C][=C][N][Ring1][=Branch1][N][=Ring1][=Branch2] | c16nc2ccccn2n1.c17ccccc1.C5C7O.O=C34.N35.N46 |
1926035 | CC1CN(c2ccccc2NC(=O)NC2CCCC2C#N)CC(C)O1 | [C][C][C][N][Branch2][Ring1][Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][Branch1][C][#N][C][C][Branch1][C][C][O][Ring2][Ring1][Branch2] | CC1CN5CC(C)O1.c15ccccc16.C17CCCC1C#N.C34=O.N36.N47 |
1926036 | CCCCNC(=O)N1CCCCC1c1nc[nH]n1 | [C][C][C][C][N][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][=Branch1][C][N][=C][NH1][N][=Ring1][Branch1] | N13CCCCC15.c15nc[nH]n1.CCCC4.C23=O.N24 |
1926037 | COC(=O)c1cccc(C(=O)OC2CCN(CC(F)F)CC2)c1 | [C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][O][C][C][C][N][Branch1][#Branch1][C][C][Branch1][C][F][F][C][C][Ring1][#Branch2][=C][Ring2][Ring1][Ring1] | c17cccc8c1.C15CCN6CC1.C6C(F)F.C37=O.C48=O.CO3.O45 |
1926038 | COc1ccc(C(NC(=O)c2ccc[nH]2)C(F)(F)F)cc1 | [C][O][C][=C][C][=C][Branch2][Ring1][Branch2][C][Branch1][=N][N][C][=Branch1][C][=O][C][=C][C][=C][NH1][Ring1][Branch1][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring2][Ring1][Ring1] | c14ccc7cc1.C57C(F)(F)F.c16ccc[nH]1.C36=O.CO4.N35 |
1926039 | COc1ccc(C(NC(=O)C(O)c2ccccc2)C(F)(F)F)cc1 | [C][O][C][=C][C][=C][Branch2][Ring1][=C][C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring2][Ring1][=Branch1] | c14ccc6cc1.C56C(F)(F)F.c17ccccc1.C3(=O)C7O.CO4.N35 |
1926040 | O=C(Nc1ccc(O)cc1F)c1cccc2cn[nH]c12 | [O][=C][Branch1][=C][N][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][F][C][=C][C][=C][C][C][=N][NH1][C][Ring1][=Branch2][=Ring1][Branch1] | c15cccc2cn[nH]c12.c14ccc(O)cc1F.O=C35.N34 |
1926041 | Cc1nccc(NC(=O)CCc2ccncc2)c1Cl | [C][C][=N][C][=C][C][Branch1][S][N][C][=Branch1][C][=O][C][C][C][=C][C][=N][C][=C][Ring1][=Branch1][=C][Ring1][P][Cl] | Cc1nccc4c1Cl.c15ccncc1.C3(=O)CC5.N34 |
1926042 | Cc1nccc(NC(=O)C(C)(C)c2ccc3c(c2)OCCO3)c1Cl | [C][C][=N][C][=C][C][Branch2][Ring1][=N][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][O][Ring1][#Branch1][=C][Ring2][Ring1][=Branch1][Cl] | c16ccc2c(c1)OCCO2.Cc1nccc5c1Cl.C4(=O)C6(C)C.N45 |
1926043 | COC(=O)c1[nH]c(C)cc1NC(=O)CNC(=O)Cc1ccc(O)cc1 | [C][O][C][=Branch1][C][=O][C][NH1][C][Branch1][C][C][=C][C][=Ring1][=Branch1][N][C][=Branch1][C][=O][C][N][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1] | c17[nH]c(C)cc16.c18ccc(O)cc1.C3(=O)C5.C4(=O)C8.C27=O.CO2.N36.N45 |
1926044 | O=C(c1ccc(O)c(Cl)c1)N(Cc1ccncc1)CC1CCCO1 | [O][=C][Branch1][#C][C][=C][C][=C][Branch1][C][O][C][Branch1][C][Cl][=C][Ring1][Branch2][N][Branch1][#Branch2][C][C][=C][C][=N][C][=C][Ring1][=Branch1][C][C][C][C][C][O][Ring1][Branch1] | c15ccc(O)c(Cl)c1.c17ccncc1.C16CCCO1.O=C25.N234.C37.C46 |
1926045 | CCC1(C(=O)NC2CC2)CCN(C(=O)c2ccccc2)CC1 | [C][C][C][Branch1][O][C][=Branch1][C][=O][N][C][C][C][Ring1][Ring1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring2][Ring1][Ring2] | C168CCN4CC1.c17ccccc1.C36=O.C15CC1.C47=O.CC8.N35 |
1926047 | CC(C)(C)c1ccc2c(c1)CN(C(=O)Cn1ccnn1)CC2 | [C][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][N][Branch1][=N][C][=Branch1][C][=O][C][N][C][=C][N][=N][Ring1][Branch1][C][C][Ring1][#C] | c15ccc2c(c1)CN3CC2.n14ccnn1.CC5(C)C.C3(=O)C4 |
1926048 | COc1cncc(CCC(=O)Nc2ccc3ccn(C)c3c2)c1 | [C][O][C][=C][N][=C][C][Branch2][Ring1][Branch2][C][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][N][Branch1][C][C][C][Ring1][=Branch1][=C][Ring1][#Branch2][=C][Ring2][Ring1][Branch1] | c16ccc2ccn(C)c2c1.c15cncc7c1.C7CC4=O.CO5.N46 |
1926049 | O=C(Nc1cccc2[nH]cnc12)c1ccc(OCC(F)(F)F)nn1 | [O][=C][Branch1][#C][N][C][=C][C][=C][C][NH1][C][=N][C][Ring1][=Branch2][=Ring1][Branch1][C][=C][C][=C][Branch1][O][O][C][C][Branch1][C][F][Branch1][C][F][F][N][=N][Ring1][N] | c16cccc2[nH]cnc12.c17ccc5nn1.C4C(F)(F)F.O=C37.N36.O45 |
1926050 | Clc1cnccc1CN(Cc1cccnc1)Cc1ccco1 | [Cl][C][=C][N][=C][C][=C][Ring1][=Branch1][C][N][Branch1][#Branch2][C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][C][=C][C][=C][O][Ring1][Branch1] | Clc1cnccc16.c17cccnc1.c15ccco1.N234.C26.C37.C45 |
1926051 | O=C1CCCCN1CSc1nnc2c(Cl)cc(Cl)cn12 | [O][=C][C][C][C][C][N][Ring1][=Branch1][C][S][C][=N][N][=C][C][Branch1][C][Cl][=C][C][Branch1][C][Cl][=C][N][Ring1][O][Ring1][Branch2] | c14nnc2c(Cl)cc(Cl)cn12.O=C1CCCCN13.C3S4 |
1926052 | O=C(NC1C=CC(CO)C1)NC(CC1CCOCC1)c1ccccc1 | [O][=C][Branch1][=N][N][C][C][=C][C][Branch1][Ring1][C][O][C][Ring1][#Branch1][N][C][Branch1][#Branch2][C][C][C][C][O][C][C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1] | C15C=CC6C1.C17CCOCC1.c18ccccc1.C48C7.O=C23.N25.C6O.N34 |
1926053 | COC(=O)c1ccc(F)c(Cn2cnc3c(cnn3C(C)C)c2=O)c1 | [C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][Branch2][Ring1][#Branch1][C][N][C][=N][C][=C][Branch1][O][C][=N][N][Ring1][Branch1][C][Branch1][C][C][C][C][Ring1][N][=O][=C][Ring2][Ring1][Branch1] | n16cnc2c(cnn27)c1=O.c15ccc(F)c8c1.C45=O.C7(C)C.CO4.C68 |
1926054 | O=C1C(NCc2cccnc2)CCCN1CCN1CCOCC1 | [O][=C][C][Branch1][O][N][C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][C][C][N][Ring1][=C][C][C][N][C][C][O][C][C][Ring1][=Branch1] | O=C1C5CCCN16.c17cccnc1.N14CCOCC1.C6C4.N35.C37 |
1926055 | Cc1nn(-c2ccccc2)cc1CNC(C)c1cncc(F)c1 | [C][C][=N][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][O][C][N][C][Branch1][C][C][C][=C][N][=C][C][Branch1][C][F][=C][Ring1][#Branch1] | Cc1nn7cc15.c16cncc(F)c1.c17ccccc1.C46C.C35.N34 |
1926056 | Cn1cnn(CC(=O)Nc2cc(-c3ccc4c(c3)CCC4)no2)c1=O | [C][N][C][=N][N][Branch2][Ring1][#C][C][C][=Branch1][C][=O][N][C][=C][C][Branch1][S][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][Ring1][=Branch1][=N][O][Ring1][=C][C][Ring2][Ring1][#Branch1][=O] | c18ccc2c(c1)CCC2.Cn1cnn7c1=O.c16cc8no1.C7C5=O.N56 |
1926057 | Cc1[nH]nc(NC(=O)Cn2ncn(C)c2=O)c1-c1cccc(Cl)c1 | [C][C][NH1][N][=C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][N][N][=C][N][Branch1][C][C][C][Ring1][=Branch1][=O][C][=Ring1][S][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1] | Cc1[nH]nc4c16.n15ncn(C)c1=O.c16cccc(Cl)c1.C3(=O)C5.N34 |
1926060 | O=C(C1CCCC1)N1CC(S(=O)(=O)NCc2ccccn2)C1 | [O][=C][Branch1][Branch2][C][C][C][C][C][Ring1][Branch1][N][C][C][Branch2][Ring1][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][=C][C][=C][C][=N][Ring1][=Branch1][C][Ring1][#C] | N13CC(S5(=O)=O)C1.c17ccccn1.C16CCCC1.O=C36.N45.C47 |
1926061 | N#Cc1nccnc1N1CCCC(S(=O)(=O)NC2CCCC2)C1 | [N][#C][C][=N][C][=C][N][=C][Ring1][=Branch1][N][C][C][C][C][Branch1][S][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][C][C][Ring1][Branch1][C][Ring1][#C] | N14CCCC(S3(=O)=O)C1.N#Cc1nccnc14.C15CCCC1.N35 |
1926062 | O=S(=O)(NC1CCCC1)C1CN(S(=O)(=O)c2cccnc2)C1 | [O][=S][=Branch1][C][=O][Branch1][=Branch2][N][C][C][C][C][C][Ring1][Branch1][C][C][N][Branch1][S][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring1][=N] | S4(=O)(=O)c1cccnc1.O=S3(=O)C1CN4C1.C15CCCC1.N35 |
1926063 | Cn1ccc(NC(=O)N2CC(S(=O)(=O)NC3CCCC3)C2)n1 | [C][N][C][=C][C][Branch2][Ring1][=N][N][C][=Branch1][C][=O][N][C][C][Branch1][S][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][C][C][Ring1][Branch1][C][Ring1][=N][=N][Ring2][Ring1][Branch1] | N15CC(S6(=O)=O)C1.Cn1ccc7n1.C18CCCC1.C45=O.N47.N68 |
1926064 | Cc1cc(NC(=O)N2CC(S(=O)(=O)NC3CCCC3)C2)nn1C | [C][C][=C][C][Branch2][Ring1][=N][N][C][=Branch1][C][=O][N][C][C][Branch1][S][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][C][C][Ring1][Branch1][C][Ring1][=N][=N][N][Ring2][Ring1][Branch1][C] | N15CC(S6(=O)=O)C1.Cc1cc7nn1C.C18CCCC1.C45=O.N47.N68 |
1926065 | Cc1cc(CN(C)S(=O)(=O)C2CN(C(=O)C3CCCC3)C2)no1 | [C][C][=C][C][Branch2][Ring1][S][C][N][Branch1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][N][Branch1][N][C][=Branch1][C][=O][C][C][C][C][C][Ring1][Branch1][C][Ring1][O][=N][O][Ring2][Ring1][=Branch1] | S6(=O)(=O)C1CN4C1.Cc1cc8no1.C17CCCC1.N56C.C47=O.C58 |
1926066 | CN(Cc1ccccn1)S(=O)(=O)C1CN(C(=O)C2CCCC2)C1 | [C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=N][Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][C][C][N][Branch1][N][C][=Branch1][C][=O][C][C][C][C][C][Ring1][Branch1][C][Ring1][O] | S5(=O)(=O)C1CN3C1.c17ccccn1.C16CCCC1.CN45.C36=O.C47 |
1926067 | O=C(c1ccccn1)N1CC(S(=O)(=O)NC2CCCC2)C1 | [O][=C][Branch1][=Branch2][C][=C][C][=C][C][=N][Ring1][=Branch1][N][C][C][Branch1][S][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][C][C][Ring1][Branch1][C][Ring1][=N] | N13CC(S4(=O)=O)C1.c16ccccn1.C15CCCC1.O=C36.N45 |
1926068 | COc1cccc(C(=O)N2CC(S(=O)(=O)NC3CCCC3)C2)n1 | [C][O][C][=C][C][=C][C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C][Branch1][S][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][C][C][Ring1][Branch1][C][Ring1][=N][=N][Ring2][Ring1][Branch1] | N14CC(S6(=O)=O)C1.c15cccc8n1.C17CCCC1.C48=O.CO5.N67 |
1926069 | O=C(C1CCCC1)N1CC(S(=O)(=O)NCc2ncccc2F)C1 | [O][=C][Branch1][Branch2][C][C][C][C][C][Ring1][Branch1][N][C][C][Branch2][Ring1][Ring1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][=N][C][=C][C][=C][Ring1][=Branch1][F][C][Ring1][S] | N13CC(S5(=O)=O)C1.c17ncccc1F.C16CCCC1.O=C36.N45.C47 |
1926070 | CC(C)Cn1cc(C(=O)N2CCCC2c2nc3ccccc3[nH]2)cn1 | [C][C][Branch1][C][C][C][N][C][=C][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][=Branch2][C][=N][Ring2][Ring1][Branch1] | c17nc2ccccc2[nH]1.n16cc5cn1.N14CCCC17.CC(C)C6.C45=O |
1926071 | Cc1cc(-c2noc(-c3cc(S(N)(=O)=O)c(C)o3)n2)ccc1F | [C][C][=C][C][Branch2][Ring1][#C][C][=N][O][C][Branch2][Ring1][Branch1][C][=C][C][Branch1][=Branch2][S][Branch1][C][N][=Branch1][C][=O][=O][=C][Branch1][C][C][O][Ring1][#Branch2][=N][Ring1][#C][=C][C][=C][Ring2][Ring1][Branch1][F] | c14cc(S(N)(=O)=O)c(C)o1.Cc1cc5ccc1F.c15noc4n1 |
1926072 | NS(=O)(=O)c1cc(-c2nc(Cc3ccc(Cl)cc3)no2)co1 | [N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][Branch2][Ring1][=Branch1][C][=N][C][Branch1][=N][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][=N][O][Ring1][=N][=C][O][Ring2][Ring1][C] | NS(=O)(=O)c1cc6co1.c15ccc(Cl)cc1.c16nc4no1.C45 |
1926073 | NS(=O)(=O)c1ccc(-c2nc(-c3cc(F)c(F)c(F)c3)no2)o1 | [N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][N][C][=N][C][Branch2][Ring1][C][C][=C][C][Branch1][C][F][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][=Branch2][=N][O][Ring1][=C][O][Ring2][Ring1][Ring1] | NS(=O)(=O)c1ccc4o1.c15cc(F)c(F)c(F)c1.c14nc5no1 |
1926074 | COc1ncc(NCC=Cc2ccco2)cc1C(N)=O | [C][O][C][=N][C][=C][Branch1][N][N][C][C][=C][C][=C][C][=C][O][Ring1][Branch1][C][=C][Ring1][#C][C][Branch1][C][N][=O] | c13ncc5cc16.C=7c1ccco1.C4C=7.C6(N)=O.CO3.N45 |
1926076 | N#Cc1ccc(S(=O)(=O)NC(C#N)C2CC2)c(Cl)c1 | [N][#C][C][=C][C][=C][Branch2][Ring1][Ring1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][Branch1][Ring1][C][#N][C][C][C][Ring1][Ring1][C][Branch1][C][Cl][=C][Ring1][P] | N#Cc1ccc(S4(=O)=O)c(Cl)c1.C35C#N.C15CC1.N34 |
1926077 | CCOc1ccc(S(=O)(=O)NCc2ccco2)cn1 | [C][C][O][C][=C][C][=C][Branch1][P][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][=C][C][=C][O][Ring1][Branch1][C][=N][Ring1][S] | c14ccc(S6(=O)=O)cn1.c17ccco1.CC3.O34.N56.C57 |
1926078 | CCOc1ccc(S(=O)(=O)N(C)Cc2ccco2)cn1 | [C][C][O][C][=C][C][=C][Branch2][Ring1][Ring2][S][=Branch1][C][=O][=Branch1][C][=O][N][Branch1][C][C][C][C][=C][C][=C][O][Ring1][Branch1][C][=N][Ring1][P] | c14ccc(S6(=O)=O)cn1.c17ccco1.N56C.CC3.O34.C57 |
1926079 | CCOc1ccc(S(=O)(=O)N(C)C(C)c2ccco2)cn1 | [C][C][O][C][=C][C][=C][Branch2][Ring1][#Branch1][S][=Branch1][C][=O][=Branch1][C][=O][N][Branch1][C][C][C][Branch1][C][C][C][=C][C][=C][O][Ring1][Branch1][C][=N][Ring2][Ring1][C] | c14ccc(S6(=O)=O)cn1.c17ccco1.N56C.C57C.CC3.O34 |
1926080 | Cn1nnc2cc(C(=O)Nc3ccnc4ncnn34)ccc21 | [C][N][N][=N][C][=C][C][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][=C][C][=N][C][=N][C][=N][N][Ring1][=Branch2][Ring1][Branch1][=C][C][=C][Ring2][Ring1][C][Ring2][Ring1][Branch1] | Cn1nnc2cc7ccc21.c16ccnc2ncnn12.C57=O.N56 |
1926081 | Cn1cc(Br)c(=O)c(NC(=O)c2ccc3cc[nH]c3c2)c1 | [C][N][C][=C][Branch1][C][Br][C][=Branch1][C][=O][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][NH1][C][Ring1][Branch1][=C][Ring1][=Branch2][=C][Ring2][Ring1][Ring2] | Cn1cc5c(=O)c(Br)c1.c16ccc2cc[nH]c2c1.C46=O.N45 |
1926082 | CC1CCOC1C(=O)Nc1cn(C)cc(Br)c1=O | [C][C][C][C][O][C][Ring1][Branch1][C][=Branch1][C][=O][N][C][=C][N][Branch1][C][C][C][=C][Branch1][C][Br][C][Ring1][Branch2][=O] | c13cn(C)cc(Br)c1=O.CC1CCOC14.C24=O.N23 |
1926083 | CCC(C)(CO)NC(=O)c1cc(F)cc2cccnc12 | [C][C][C][Branch1][C][C][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][C][=C][C][=C][N][=C][Ring1][O][Ring1][=Branch1] | c15cc(F)cc2cccnc12.CCC4(C)CO.C35=O.N34 |
1926084 | CC(C)C(NC(=O)CCc1nc[nH]n1)c1ccc(Cl)cc1F | [C][C][Branch1][C][C][C][Branch1][#C][N][C][=Branch1][C][=O][C][C][C][N][=C][NH1][N][=Ring1][Branch1][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][F] | c15ccc(Cl)cc1F.CC(C)C35.C2(=O)CC4.c14nc[nH]n1.N23 |
1926085 | N#Cc1nccnc1NC1CCCC2(C1)OCCO2 | [N][#C][C][=N][C][=C][N][=C][Ring1][=Branch1][N][C][C][C][C][C][Branch1][Ring2][C][Ring1][=Branch1][O][C][C][O][Ring1][=Branch1] | C14CCCC2(C1)OCCO2.N#Cc1nccnc13.N34 |
1926086 | COc1ccc(OC)c(C2CCCN2c2cc(=O)[nH]c(=O)[nH]2)c1 | [C][O][C][=C][C][=C][Branch1][Ring1][O][C][C][Branch2][Ring1][=Branch1][C][C][C][C][N][Ring1][Branch1][C][=C][C][=Branch1][C][=O][NH1][C][=Branch1][C][=O][NH1][Ring1][Branch2][=C][Ring2][Ring1][Branch1] | c13ccc4c6c1.c15cc(=O)[nH]c(=O)[nH]1.C16CCCN15.CO3.O4C |
1926087 | COc1cccc(CCNc2cnccc2C(N)=O)c1 | [C][O][C][=C][C][=C][C][Branch1][P][C][C][N][C][=C][N][=C][C][=C][Ring1][=Branch1][C][Branch1][C][N][=O][=C][Ring2][Ring1][C] | c13cccc7c1.c15cnccc16.C7C4.C6(N)=O.CO3.N45 |
1926088 | CN(C)C(=O)c1cc(NCCSc2ccccc2F)ccc1F | [C][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][Branch1][=C][N][C][C][S][C][=C][C][=C][C][=C][Ring1][=Branch1][F][=C][C][=C][Ring1][P][F] | c17cc6ccc1F.c18ccccc1F.CN3C.C37=O.C4C5.N46.S58 |
1926089 | CCC(NC(=O)c1cc(F)cc2cccnc12)(C(N)=O)C(C)C | [C][C][C][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][C][=C][C][=C][N][=C][Ring1][O][Ring1][=Branch1][Branch1][=Branch1][C][Branch1][C][N][=O][C][Branch1][C][C][C] | c15cc(F)cc2cccnc12.CCC4(C(N)=O)C(C)C.C35=O.N34 |
1926090 | CC(C)(C#N)CSc1nnnn1CC1CCCO1 | [C][C][Branch1][C][C][Branch1][Ring1][C][#N][C][S][C][=N][N][=N][N][Ring1][Branch1][C][C][C][C][C][O][Ring1][Branch1] | CC(C)(C#N)C2.c15nnnn13.C14CCCO1.S25.C34 |
1926091 | CN(C)c1ccc(C(=O)Nc2nc(C(N)=O)co2)cn1 | [C][N][Branch1][C][C][C][=C][C][=C][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][=N][C][Branch1][=Branch1][C][Branch1][C][N][=O][=C][O][Ring1][Branch2][C][=N][Ring1][P] | c14ccc7cn1.c15nc6co1.CN4C.C37=O.C6(N)=O.N35 |
1926092 | O=S(=O)(c1ccc2ccccc2c1)N1CCCC1c1ncc[nH]1 | [O][=S][=Branch1][C][=O][Branch1][#C][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2][N][C][C][C][C][Ring1][Branch1][C][=N][C][=C][NH1][Ring1][Branch1] | O=S3(=O)c1ccc2ccccc2c1.N13CCCC14.c14ncc[nH]1 |
1926094 | Cc1ccc(S(=O)(=O)N2CCOCC2C2CCCC2=O)cc1 | [C][C][=C][C][=C][Branch2][Ring1][Branch2][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][O][C][C][Ring1][=Branch1][C][C][C][C][C][Ring1][Branch1][=O][C][=C][Ring2][Ring1][Branch1] | Cc1ccc(S3(=O)=O)cc1.N13CCOCC14.C14CCCC1=O |
1926095 | O=C1CCCC1C1COCCN1S(=O)(=O)c1ccccc1F | [O][=C][C][C][C][C][Ring1][Branch1][C][C][O][C][C][N][Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][F] | S2(=O)(=O)c1ccccc1F.C13COCCN12.O=C1CCCC13 |
1926096 | CN1CN(C(=O)NCCN2CCOCC2)CC1=O | [C][N][C][N][Branch1][S][C][=Branch1][C][=O][N][C][C][N][C][C][O][C][C][Ring1][=Branch1][C][C][Ring1][S][=O] | CN1CN3CC1=O.N16CCOCC1.C34=O.C5C6.N45 |
1926097 | O=C(NC1CCCC2(C1)OCCO2)c1cc(Cl)ccn1 | [O][=C][Branch2][Ring1][C][N][C][C][C][C][C][Branch1][Ring2][C][Ring1][=Branch1][O][C][C][O][Ring1][=Branch1][C][=C][C][Branch1][C][Cl][=C][C][=N][Ring1][#Branch1] | C14CCCC2(C1)OCCO2.c15cc(Cl)ccn1.O=C35.N34 |
1926098 | O=C(NC1CN(c2ccccc2)C1=O)c1ccnc(F)c1 | [O][=C][Branch2][Ring1][Ring1][N][C][C][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2][=O][C][=C][C][=N][C][Branch1][C][F][=C][Ring1][#Branch1] | c15ccnc(F)c1.C14CN6C1=O.c16ccccc1.O=C35.N34 |
1926099 | Cc1ncn(CC(O)c2cc(F)ccc2F)c(=O)c1C | [C][C][N][=C][N][Branch2][Ring1][C][C][C][Branch1][C][O][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][F][C][=Branch1][C][=O][C][=Ring2][Ring1][C][C] | Cc1ncn3c(=O)c1C.c14cc(F)ccc1F.C3C4O |
1926100 | Cc1ncn(CC(O)COc2ccc(F)cc2)c(=O)c1C | [C][C][N][=C][N][Branch2][Ring1][Ring1][C][C][Branch1][C][O][C][O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][C][=Ring2][Ring1][Ring1][C] | Cc1ncn5c(=O)c1C.c14ccc(F)cc1.C5C(O)C3.O34 |
1926103 | N#Cc1c(NCCNC(=O)C2CCCCC2)nc2ccccn12 | [N][#C][C][=C][Branch1][P][N][C][C][N][C][=Branch1][C][=O][C][C][C][C][C][C][Ring1][=Branch1][N][=C][C][=C][C][=C][N][Ring2][Ring1][Branch1][Ring1][=Branch1] | N#Cc1c6nc2ccccn12.C17CCCCC1.C4C5.C37=O.N46.N35 |
1926104 | CC(=O)c1ccc(S(C)(=O)=O)c(N(C)CCn2cccn2)c1 | [C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][Branch1][=C][N][Branch1][C][C][C][C][N][C][=C][C][=N][Ring1][Branch1][=C][Ring2][Ring1][Ring1] | c15ccc(S(C)(=O)=O)c4c1.n16cccn1.CC5=O.N34C.C3C6 |
1926105 | CC(=O)c1ccc(S(C)(=O)=O)c(N(C)CC2CCC2)c1 | [C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][Branch1][N][N][Branch1][C][C][C][C][C][C][C][Ring1][Ring2][=C][Ring1][P] | c15ccc(S(C)(=O)=O)c4c1.C16CCC1.CC5=O.N34C.C36 |
1926106 | FC(F)(F)COCCOc1ccc2ncccc2c1 | [F][C][Branch1][C][F][Branch1][C][F][C][O][C][C][O][C][=C][C][=C][N][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2] | c16ccc2ncccc2c1.FC(F)(F)C3.C4C5.O34.O56 |
1926108 | CC(=O)c1ccc(S(C)(=O)=O)c(N2CCC3(CCCC3)CC2)c1 | [C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][Branch1][P][N][C][C][C][Branch1][#Branch1][C][C][C][C][Ring1][Branch1][C][C][Ring1][#Branch2][=C][Ring2][Ring1][Ring2] | c15ccc(S(C)(=O)=O)c4c1.N14CCC2(CCCC2)CC1.CC5=O |
1926109 | O=S(=O)(NCC(O)C1CCCC1)c1ccc(C(F)(F)F)nc1 | [O][=S][=Branch1][C][=O][Branch1][=C][N][C][C][Branch1][C][O][C][C][C][C][C][Ring1][Branch1][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][N][=C][Ring1][#Branch2] | O=S3(=O)c1ccc4nc1.C15CCCC1.C2C5O.C4(F)(F)F.N23 |
1926110 | CC1CN(CCc2ccc3c(c2)OCCO3)CC(c2ccccc2)O1 | [C][C][C][N][Branch2][Ring1][Ring1][C][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][O][Ring1][#Branch1][C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring2][Ring1][Branch2] | c15ccc2c(c1)OCCO2.CC1CN4CC6O1.c16ccccc1.C4C5 |
1926111 | O=S(=O)(NC(CO)c1ccco1)c1ccc(C(F)(F)F)nc1 | [O][=S][=Branch1][C][=O][Branch1][=C][N][C][Branch1][Ring1][C][O][C][=C][C][=C][O][Ring1][Branch1][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][N][=C][Ring1][#Branch2] | O=S3(=O)c1ccc5nc1.c14ccco1.C24CO.C5(F)(F)F.N23 |
1926112 | O=C(NC1CCOC1)N(c1ccccc1)c1ccccc1 | [O][=C][Branch1][=Branch2][N][C][C][C][O][C][Ring1][Branch1][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1] | c14ccccc1.c15ccccc1.C16CCOC1.O=C23.N345.N26 |
1926113 | Cn1cc(C(CO)NC(=O)N(c2ccccc2)c2ccccc2)cn1 | [C][N][C][=C][Branch2][Ring1][=C][C][Branch1][Ring1][C][O][N][C][=Branch1][C][=O][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=N][Ring2][Ring1][Branch2] | Cn1cc8cn1.c16ccccc1.c17ccccc1.C58CO.C34=O.N467.N35 |
1926115 | Cn1cc(CNC(=O)N2CCC(C(N)=O)CC2)c(-c2ccccc2)n1 | [C][N][C][=C][Branch2][Ring1][=Branch1][C][N][C][=Branch1][C][=O][N][C][C][C][Branch1][=Branch1][C][Branch1][C][N][=O][C][C][Ring1][=Branch2][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][Ring2][Ring1][Branch2] | Cn1cc7c8n1.N14CCC6CC1.c18ccccc1.C34=O.C6(N)=O.C57.N35 |
1926116 | Cn1cc(CNC(=O)N2CCC(C#N)CC2)c(-c2ccccc2)n1 | [C][N][C][=C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][N][C][C][C][Branch1][Ring1][C][#N][C][C][Ring1][Branch2][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][Ring2][Ring1][#Branch1] | N14CCC(C#N)CC1.Cn1cc6c7n1.c17ccccc1.C34=O.C56.N35 |
1926117 | CCn1cnnc1C1CCCN(C(=O)Nc2ccccc2N(C)C)C1 | [C][C][N][C][=N][N][=C][Ring1][Branch1][C][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][C][C][C][C][Ring2][Ring1][C] | C18CCCN3C1.c15ccccc16.n17cnnc18.C34=O.N6(C)C.CC7.N45 |
1926118 | CCn1cnnc1C1CCCN(C(=O)Nc2cc(F)cc(OC)c2)C1 | [C][C][N][C][=N][N][=C][Ring1][Branch1][C][C][C][C][N][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][=C][C][Branch1][C][F][=C][C][Branch1][Ring1][O][C][=C][Ring1][=Branch2][C][Ring2][Ring1][C] | c16cc5cc(F)c1.C18CCCN3C1.n17cnnc18.C34=O.CC7.N46.O5C |
1926119 | CCn1cnnc1C1CCCN(C(=O)Nc2cc(C)ccc2Cl)C1 | [C][C][N][C][=N][N][=C][Ring1][Branch1][C][C][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][=C][C][Branch1][C][C][=C][C][=C][Ring1][#Branch1][Cl][C][Ring1][P] | c15cc(C)ccc1Cl.C17CCCN3C1.n16cnnc17.C34=O.CC6.N45 |
1926120 | CCn1cnnc1C1CCCN(C(=O)Nc2cc(C)cc(F)c2)C1 | [C][C][N][C][=N][N][=C][Ring1][Branch1][C][C][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][=C][C][Branch1][C][C][=C][C][Branch1][C][F][=C][Ring1][Branch2][C][Ring1][P] | c15cc(C)cc(F)c1.C17CCCN3C1.n16cnnc17.C34=O.CC6.N45 |
1926121 | Cn1ncnc1NC(=O)NCc1ncc(-c2ccccc2)[nH]1 | [C][N][N][=C][N][=C][Ring1][Branch1][N][C][=Branch1][C][=O][N][C][C][=N][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][O] | Cn1ncnc16.c17ncc8[nH]1.c18ccccc1.C34=O.N36.N45.C57 |
1926122 | CCn1cnnc1C1CCCN(C(=O)Nc2cc(F)ccc2OC)C1 | [C][C][N][C][=N][N][=C][Ring1][Branch1][C][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][O][C][C][Ring2][Ring1][C] | c16cc(F)ccc15.C18CCCN3C1.n17cnnc18.C34=O.CC7.N46.O5C |
1926123 | Cc1cc(C)n(CCCNC(=O)Nc2cncnc2N(C)C)n1 | [C][C][C][=C][Branch1][C][C][N][Branch2][Ring1][#Branch1][C][C][C][N][C][=Branch1][C][=O][N][C][=C][N][=C][N][=C][Ring1][=Branch1][N][Branch1][C][C][C][N][=Ring2][Ring1][=Branch1] | Cc1cc(C)n8n1.c17cncnc16.C8CC5.C34=O.N6(C)C.N35.N47 |
1926124 | CCC1(CNC(=O)Nc2cncnc2N(C)C)CC1 | [C][C][C][Branch2][Ring1][Branch1][C][N][C][=Branch1][C][=O][N][C][=C][N][=C][N][=C][Ring1][=Branch1][N][Branch1][C][C][C][C][C][Ring1][P] | c17cncnc16.C189CC1.C34=O.N6(C)C.CC8.C59.N35.N47 |
1926126 | Cn1cc(NC(=O)Nc2cc(F)c(OC(C)(C)C)c(F)c2)cn1 | [C][N][C][=C][Branch2][Ring1][S][N][C][=Branch1][C][=O][N][C][=C][C][Branch1][C][F][=C][Branch1][#Branch2][O][C][Branch1][C][C][Branch1][C][C][C][C][Branch1][C][F][=C][Ring1][=N][C][=N][Ring2][Ring1][=Branch1] | c18cc(F)c6c(F)c1.Cn1cc7cn1.C5(C)(C)C.C34=O.N37.N48.O56 |
1926128 | O=C(NCCn1ccnn1)NC1C2CC3CC(C2)CC1C3 | [O][=C][Branch1][O][N][C][C][N][C][=C][N][=N][Ring1][Branch1][N][C][C][C][C][C][C][Branch1][Ring2][C][Ring1][=Branch1][C][C][Ring1][=Branch2][C][Ring1][#Branch1] | C17C2CC3CC(C2)CC1C3.n18ccnn1.O=C45.C6C8.N46.N57 |
1926129 | Cc1ccccc1CNc1ccccc1NC(=O)C1CN(C)CCO1 | [C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][N][Branch1][C][C][C][C][O][Ring1][#Branch1] | Cc1ccccc17.c14ccccc15.C16CN(C)CCO1.C26=O.C37.N34.N25 |
1926130 | COC(=O)c1ccc(F)c(CNC(=O)c2ccc[nH]2)c1 | [C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][Branch1][=C][C][N][C][=Branch1][C][=O][C][=C][C][=C][NH1][Ring1][Branch1][=C][Ring1][S] | c17ccc(F)c8c1.c16ccc[nH]1.C37=O.C46=O.CO3.C58.N45 |
1926131 | O=C(Nc1nc2c(s1)CCC2)c1cccc(-n2ccnc2)n1 | [O][=C][Branch1][S][N][C][=N][C][=C][Branch1][Ring2][S][Ring1][Branch1][C][C][C][Ring1][=Branch1][C][=C][C][=C][C][Branch1][Branch2][N][C][=C][N][=C][Ring1][Branch1][=N][Ring1][O] | c14nc2c(s1)CCC2.c15cccc6n1.n16ccnc1.O=C35.N34 |
1926132 | Cn1ccc2ccc(NC(=O)c3cccc(-n4ccnc4)n3)cc21 | [C][N][C][=C][C][=C][C][=C][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][Branch2][N][C][=C][N][=C][Ring1][Branch1][=N][Ring1][O][C][=C][Ring2][Ring1][Ring2][Ring2][Ring1][#Branch1] | Cn1ccc2ccc6cc21.c17cccc8n1.n18ccnc1.C57=O.N56 |
1926133 | O=S1(=O)c2cccc3cccc(c23)N1Cc1nc(C2CC2)n[nH]1 | [O][=S][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][C][=Branch1][=Branch1][=C][Ring1][#Branch2][Ring1][=Branch1][N][Ring1][=N][C][C][=N][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][NH1][Ring1][Branch2] | O=S1(=O)c2cccc3cccc(c23)N14.c15nc6n[nH]1.C16CC1.C45 |
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