ID large_stringlengths 1 7 | smiles stringlengths 15 57 | selfies stringlengths 55 294 | safe stringlengths 15 83 |
|---|---|---|---|
1927813 | CS(=O)(=O)N1CC2COCC2(C(=O)NCCc2cccs2)C1 | [C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][O][C][C][Ring1][Branch1][Branch1][#C][C][=Branch1][C][=O][N][C][C][C][=C][C][=C][S][Ring1][Branch1][C][Ring2][Ring1][C] | N15CC2COCC26C1.c17cccs1.CS5(=O)=O.C36=O.C4C7.N34 |
1927814 | O=C(c1ccncn1)N1CC2COCC2(c2nnc(C3CC3)o2)C1 | [O][=C][Branch1][=Branch2][C][=C][C][=N][C][=N][Ring1][=Branch1][N][C][C][C][O][C][C][Ring1][Branch1][Branch1][#C][C][=N][N][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][O][Ring1][Branch2][C][Ring1][S] | N14CC2COCC26C1.c15ccncn1.c16nnc7o1.O=C45.C17CC1 |
1927815 | O=C(N1CCCC1)N1CC2COCC2(c2nnc(C3CC3)o2)C1 | [O][=C][Branch1][Branch2][N][C][C][C][C][Ring1][Branch1][N][C][C][C][O][C][C][Ring1][Branch1][Branch1][#C][C][=N][N][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][O][Ring1][Branch2][C][Ring1][S] | N15CC2COCC26C1.c16nnc7o1.N14CCCC1.O=C45.C17CC1 |
1927816 | O=C(c1ncccn1)N1CC2COCC2(c2nnc(C3CC3)o2)C1 | [O][=C][Branch1][=Branch2][C][=N][C][=C][C][=N][Ring1][=Branch1][N][C][C][C][O][C][C][Ring1][Branch1][Branch1][#C][C][=N][N][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][O][Ring1][Branch2][C][Ring1][S] | N14CC2COCC26C1.c15ncccn1.c16nnc7o1.O=C45.C17CC1 |
1927817 | Cc1cc(CN2CC3COCC3(C(=O)NC3CC(F)(F)C3)C2)no1 | [C][C][=C][C][Branch2][Ring2][C][C][N][C][C][C][O][C][C][Ring1][Branch1][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][C][C][Branch1][C][F][Branch1][C][F][C][Ring1][=Branch1][C][Ring1][P][=N][O][Ring2][Ring1][#Branch1] | N15CC2COCC27C1.Cc1cc8no1.C16CC(F)(F)C1.C47=O.C58.N46 |
1927818 | COC1CCN(C(=O)c2cccnc2)CC1Cc1ccccc1 | [C][O][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=C][N][=C][Ring1][=Branch1][C][C][Ring1][=C][C][C][=C][C][=C][C][=C][Ring1][=Branch1] | C14CCN3CC16.c15cccnc1.c17ccccc1.C35=O.CO4.C67 |
1927819 | COC1CCN(C(=O)c2ccc(C)nc2)CC1Cc1ccccc1 | [C][O][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][N][=C][Ring1][#Branch1][C][C][Ring1][#C][C][C][=C][C][=C][C][=C][Ring1][=Branch1] | C14CCN3CC16.c15ccc(C)nc1.c17ccccc1.C35=O.CO4.C67 |
1927820 | COC1CCN(C(=O)c2cnc(C)cn2)CC1Cc1ccccc1 | [C][O][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][C][C][=N][Ring1][#Branch1][C][C][Ring1][#C][C][C][=C][C][=C][C][=C][Ring1][=Branch1] | C14CCN3CC16.c15cnc(C)cn1.c17ccccc1.C35=O.CO4.C67 |
1927822 | COC1CCN(C(=O)c2cncc(C)c2)CC1Cc1ccccc1 | [C][O][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][N][=C][C][Branch1][C][C][=C][Ring1][#Branch1][C][C][Ring1][#C][C][C][=C][C][=C][C][=C][Ring1][=Branch1] | C14CCN3CC16.c15cncc(C)c1.c17ccccc1.C35=O.CO4.C67 |
1927823 | COC1CCN(C(=O)c2ccncn2)CC1Cc1ccccc1 | [C][O][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=N][C][=N][Ring1][=Branch1][C][C][Ring1][=C][C][C][=C][C][=C][C][=C][Ring1][=Branch1] | C14CCN3CC16.c15ccncn1.c17ccccc1.C35=O.CO4.C67 |
1927824 | COC1CCN(C(=O)c2cc(C3CC3)on2)CC1Cc1ccccc1 | [C][O][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][C][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][O][N][=Ring1][Branch2][C][C][Ring1][S][C][C][=C][C][=C][C][=C][Ring1][=Branch1] | C15CCN4CC17.c16cc9on1.c18ccccc1.C46=O.C19CC1.CO5.C78 |
1927825 | COC1CCN(C(=O)c2cccnc2)CC1Cc1cccc(C)c1 | [C][O][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=C][N][=C][Ring1][=Branch1][C][C][Ring1][=C][C][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1] | C14CCN3CC16.c17cccc(C)c1.c15cccnc1.C35=O.CO4.C67 |
1927826 | COC1CCN(C(=O)c2ccc(C)nc2)CC1Cc1cccc(C)c1 | [C][O][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][N][=C][Ring1][#Branch1][C][C][Ring1][#C][C][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1] | C14CCN3CC16.c15ccc(C)nc1.c17cccc(C)c1.C35=O.CO4.C67 |
1927827 | COC1CCN(C(=O)c2cnc(C)cn2)CC1Cc1cccc(C)c1 | [C][O][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][N][=C][Branch1][C][C][C][=N][Ring1][#Branch1][C][C][Ring1][#C][C][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1] | C14CCN3CC16.c15cnc(C)cn1.c17cccc(C)c1.C35=O.CO4.C67 |
1927828 | COC1CCN(C(=O)c2cncc(C)c2)CC1Cc1cccc(C)c1 | [C][O][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][N][=C][C][Branch1][C][C][=C][Ring1][#Branch1][C][C][Ring1][#C][C][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1] | C14CCN3CC16.c15cncc(C)c1.c17cccc(C)c1.C35=O.CO4.C67 |
1927830 | COc1ccc(CC2CN(C(=O)c3cccnc3)CCC2OC)cc1 | [C][O][C][=C][C][=C][Branch2][Ring1][#Branch2][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=C][N][=C][Ring1][=Branch1][C][C][C][Ring1][=C][O][C][C][=C][Ring2][Ring1][#Branch1] | C18CN4CCC15.c16ccc9cc1.c17cccnc1.C47=O.CO6.C89.O5C |
1927831 | COc1ccc(CC2CN(C(=O)c3cnccn3)CCC2OC)cc1 | [C][O][C][=C][C][=C][Branch2][Ring1][#Branch2][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][N][=C][C][=N][Ring1][=Branch1][C][C][C][Ring1][=C][O][C][C][=C][Ring2][Ring1][#Branch1] | C18CN4CCC15.c16ccc9cc1.c17cnccn1.C47=O.CO6.C89.O5C |
1927832 | COc1ccc(CC2CN(C(=O)c3ccncn3)CCC2OC)cc1 | [C][O][C][=C][C][=C][Branch2][Ring1][#Branch2][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=N][C][=N][Ring1][=Branch1][C][C][C][Ring1][=C][O][C][C][=C][Ring2][Ring1][#Branch1] | C18CN4CCC15.c16ccc9cc1.c17ccncn1.C47=O.CO6.C89.O5C |
1927833 | O=C(Cc1cccc(F)c1)N1CCC2OCCC2(COCC2CC2)C1 | [O][=C][Branch1][=N][C][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][N][C][C][C][O][C][C][C][Ring1][Branch1][Branch1][=Branch2][C][O][C][C][C][C][Ring1][Ring1][C][Ring1][#C] | N13CCC2OCCC26C1.c18cccc(F)c1.O=C3C8.C17CC1.C46.O45.C57 |
1927834 | O=C(Cc1ccccc1F)N1CCC2OCCC2(COCC2CC2)C1 | [O][=C][Branch1][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][F][N][C][C][C][O][C][C][C][Ring1][Branch1][Branch1][=Branch2][C][O][C][C][C][C][Ring1][Ring1][C][Ring1][#C] | N13CCC2OCCC26C1.c18ccccc1F.O=C3C8.C17CC1.C46.O45.C57 |
1927835 | COCC(=O)N1CCC2OCCC2(COc2cccnc2)C1 | [C][O][C][C][=Branch1][C][=O][N][C][C][C][O][C][C][C][Ring1][Branch1][Branch1][O][C][O][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring1][P] | N13CCC2OCCC27C1.c16cccnc1.C4C3=O.CO4.C57.O56 |
1927836 | CCOCC(=O)N1CCC2OCCC2(COc2cccnc2)C1 | [C][C][O][C][C][=Branch1][C][=O][N][C][C][C][O][C][C][C][Ring1][Branch1][Branch1][O][C][O][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring1][P] | N13CCC2OCCC28C1.c17cccnc1.C5C3=O.CC4.O45.C68.O67 |
1927837 | CN(C)C(=O)N1CCC2OCCC2(COc2cccnc2)C1 | [C][N][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][O][C][C][C][Ring1][Branch1][Branch1][O][C][O][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring1][P] | N14CCC2OCCC27C1.c16cccnc1.CN3C.C34=O.C57.O56 |
1927838 | CN(C)S(=O)(=O)N1CCC2OCCC2(COc2cccnc2)C1 | [C][N][Branch1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][O][C][C][C][Ring1][Branch1][Branch1][O][C][O][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring1][P] | CN(C)S(=O)(=O)N1CCC2OCCC25C1.c14cccnc1.C35.O34 |
1927839 | O=C(c1cscn1)N1CCC2OCCC2(COc2ccccn2)C1 | [O][=C][Branch1][Branch2][C][=C][S][C][=N][Ring1][Branch1][N][C][C][C][O][C][C][C][Ring1][Branch1][Branch1][O][C][O][C][=C][C][=C][C][=N][Ring1][=Branch1][C][Ring1][P] | N13CCC2OCCC27C1.c15ccccn1.c16cscn1.O=C36.C47.O45 |
1927840 | O=C(c1ncccn1)N1CCC2OCCC2(COc2ccccn2)C1 | [O][=C][Branch1][=Branch2][C][=N][C][=C][C][=N][Ring1][=Branch1][N][C][C][C][O][C][C][C][Ring1][Branch1][Branch1][O][C][O][C][=C][C][=C][C][=N][Ring1][=Branch1][C][Ring1][P] | N13CCC2OCCC27C1.c16ncccn1.c15ccccn1.O=C36.C47.O45 |
1927841 | O=C(c1cocn1)N1CCC2OCCC2(COc2ncccc2F)C1 | [O][=C][Branch1][Branch2][C][=C][O][C][=N][Ring1][Branch1][N][C][C][C][O][C][C][C][Ring1][Branch1][Branch1][N][C][O][C][=N][C][=C][C][=C][Ring1][=Branch1][F][C][Ring2][Ring1][C] | N13CCC2OCCC27C1.c15ncccc1F.c16cocn1.O=C36.C47.O45 |
1927842 | Cc1ccc(N2CCC3(CC2)COC(COc2cccnc2)C3)nn1 | [C][C][=C][C][=C][Branch2][Ring1][=N][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][O][C][Branch1][O][C][O][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring1][#C][N][=N][Ring2][Ring1][Branch2] | N16CCC2(CC1)COC7C2.Cc1ccc6nn1.c15cccnc1.C47.O45 |
1927843 | Cc1cc(CN2CCC3C(=O)N(c4cccnc4)CCOC3C2)no1 | [C][C][=C][C][Branch2][Ring1][#C][C][N][C][C][C][C][=Branch1][C][=O][N][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][C][C][O][C][Ring1][=C][C][Ring2][Ring1][C][=N][O][Ring2][Ring1][Branch2] | N15CCC2C(=O)N7CCOC2C1.Cc1cc6no1.c17cccnc1.C56 |
1927845 | O=C(c1ccsc1)N1CCC2(CC(OCc3ccccn3)CO2)C1 | [O][=C][Branch1][Branch2][C][C][=C][S][C][=Ring1][Branch1][N][C][C][C][Branch2][Ring1][Ring1][C][C][Branch1][O][O][C][C][=C][C][=C][C][=N][Ring1][=Branch1][C][O][Ring1][=N][C][Ring1][P] | N14CCC2(CC6CO2)C1.c18ccccn1.c17ccsc1.O=C47.O56.C58 |
1927846 | Cc1ccnc(C(=O)N2CC3CN(S(C)(=O)=O)CCOC3C2)c1 | [C][C][=C][C][=N][C][Branch2][Ring1][=N][C][=Branch1][C][=O][N][C][C][C][N][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][C][O][C][Ring1][O][C][Ring1][=C][=C][Ring2][Ring1][=Branch1] | N14CC2CN5CCOC2C1.Cc1ccnc6c1.S5(C)(=O)=O.C46=O |
1927847 | Cn1ccc(C(=O)N2CC3CCCC3(COCc3ccccn3)C2)n1 | [C][N][C][=C][C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][C][C][C][C][Ring1][Branch1][Branch1][N][C][O][C][C][=C][C][=C][C][=N][Ring1][=Branch1][C][Ring1][P][=N][Ring2][Ring1][Branch2] | N14CC2CCCC29C1.Cn1ccc7n1.c18ccccn1.C47=O.C59.O56.C68 |
1927848 | Cc1noc(C23COCC2CN(C(=O)c2cnccn2)C3)n1 | [C][C][=N][O][C][Branch2][Ring1][O][C][C][O][C][C][Ring1][Branch1][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][N][=C][C][=N][Ring1][=Branch1][C][Ring1][S][=N][Ring2][Ring1][Branch1] | C126COCC1CN4C2.Cc1noc6n1.c15cnccn1.C45=O |
1927849 | Cc1csc(CN2CC3COCC3(C(=O)NCc3ccco3)C2)n1 | [C][C][=C][S][C][Branch2][Ring1][=N][C][N][C][C][C][O][C][C][Ring1][Branch1][Branch1][=C][C][=Branch1][C][=O][N][C][C][=C][C][=C][O][Ring1][Branch1][C][Ring1][P][=N][Ring2][Ring1][#Branch1] | N15CC2COCC27C1.Cc1csc8n1.c19ccco1.C47=O.C58.N46.C69 |
1927850 | O=C(C1CC=CC1)N1CCC2OCCC2(COCc2ccncc2)C1 | [O][=C][Branch1][Branch2][C][C][C][=C][C][Ring1][Branch1][N][C][C][C][O][C][C][C][Ring1][Branch1][Branch1][N][C][O][C][C][=C][C][=N][C][=C][Ring1][=Branch1][C][Ring2][Ring1][C] | N13CCC2OCCC27C1.c18ccncc1.C16CC=CC1.O=C36.C47.O45.C58 |
1927852 | FC1CN(Cc2nccs2)CC1OCc1nc2ncccc2[nH]1 | [F][C][C][N][Branch1][=Branch2][C][C][=N][C][=C][S][Ring1][Branch1][C][C][Ring1][O][O][C][C][=N][C][=N][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][=Branch2] | c17nc2ncccc2[nH]1.FC1CN5CC14.c16nccs1.C56.O34.C37 |
1927853 | FC1CN(Cc2ccccc2)CC1OCc1nc2ccccc2[nH]1 | [F][C][C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][N][O][C][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][=Branch2] | c16nc2ccccc2[nH]1.FC1CN5CC14.c17ccccc1.C57.O34.C36 |
1927854 | Fc1cnccc1CN1CC(F)C(OCc2nc3ccccc3[nH]2)C1 | [F][C][=C][N][=C][C][=C][Ring1][=Branch1][C][N][C][C][Branch1][C][F][C][Branch1][S][O][C][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][=Branch2][C][Ring1][P] | c17nc2ccccc2[nH]1.Fc1cnccc18.N16CC5C(F)C1.C68.O45.C47 |
1927855 | Cn1c(COC2CN(Cc3ccncc3)CC2F)nc2ccccc21 | [C][N][C][Branch2][Ring1][=Branch1][C][O][C][C][N][Branch1][#Branch2][C][C][=C][C][=N][C][=C][Ring1][=Branch1][C][C][Ring1][N][F][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][Branch2] | Cn1c7nc2ccccc21.C15CN6CC1F.c18ccncc1.C47.O45.C68 |
1927856 | Fc1ccc2nc(COC3CN(Cc4ccccc4)CC3F)[nH]c2c1 | [F][C][=C][C][=C][N][=C][Branch2][Ring1][=Branch1][C][O][C][C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][N][F][NH1][C][Ring2][Ring1][Ring2][=C][Ring2][Ring1][Branch2] | Fc1ccc2nc8[nH]c2c1.C16CN7CC1F.c19ccccc1.C58.O56.C79 |
1927857 | Fc1ccc2nc(COC3CN(Cc4ccncc4)CC3F)[nH]c2c1 | [F][C][=C][C][=C][N][=C][Branch2][Ring1][=Branch1][C][O][C][C][N][Branch1][#Branch2][C][C][=C][C][=N][C][=C][Ring1][=Branch1][C][C][Ring1][N][F][NH1][C][Ring2][Ring1][Ring2][=C][Ring2][Ring1][Branch2] | Fc1ccc2nc8[nH]c2c1.C16CN7CC1F.c19ccncc1.C58.O56.C79 |
1927858 | Cc1ccc2nc(COC3CN(Cc4ccccc4)CC3F)[nH]c2c1 | [C][C][=C][C][=C][N][=C][Branch2][Ring1][=Branch1][C][O][C][C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][N][F][NH1][C][Ring2][Ring1][Ring2][=C][Ring2][Ring1][Branch2] | Cc1ccc2nc8[nH]c2c1.C16CN7CC1F.c19ccccc1.C58.O56.C79 |
1927859 | Cc1ccc2nc(COC3CN(Cc4ccncc4)CC3F)[nH]c2c1 | [C][C][=C][C][=C][N][=C][Branch2][Ring1][=Branch1][C][O][C][C][N][Branch1][#Branch2][C][C][=C][C][=N][C][=C][Ring1][=Branch1][C][C][Ring1][N][F][NH1][C][Ring2][Ring1][Ring2][=C][Ring2][Ring1][Branch2] | Cc1ccc2nc8[nH]c2c1.C16CN7CC1F.c19ccncc1.C58.O56.C79 |
1927860 | O=C(NCC1COCc2nc3cccnc3n21)c1ccccn1 | [O][=C][Branch2][Ring1][=Branch1][N][C][C][C][O][C][C][=N][C][=C][C][=C][N][=C][Ring1][=Branch1][N][Ring1][=Branch2][Ring1][=N][C][=C][C][=C][C][=N][Ring1][=Branch1] | C5C1COCc2nc3cccnc3n21.c16ccccn1.O=C46.N45 |
1927862 | Cc1cccc2c1nc1n2C(CNCc2ccc(C#N)cc2)COC1 | [C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=C][N][Ring1][Branch1][C][Branch1][S][C][N][C][C][=C][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][Branch2][C][O][C][Ring1][P] | Cc1cccc2c1nc1n2C(C3)COC1.c15ccc(C#N)cc1.N34.C45 |
1927864 | Cc1ccc2c(c1)nc1n2C(CNCc2ccc(C#N)cc2)COC1 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][=C][N][Ring1][=Branch1][C][Branch1][S][C][N][C][C][=C][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][Branch2][C][O][C][Ring1][P] | Cc1ccc2c(c1)nc1n2C(C3)COC1.c15ccc(C#N)cc1.N34.C45 |
1927865 | Cc1ccc2nc3n(c2c1)C(CNCc1ccc(C#N)cc1)COC3 | [C][C][=C][C][=C][N][=C][N][Branch1][#Branch1][C][Ring1][Branch1][=C][Ring1][=Branch2][C][Branch1][S][C][N][C][C][=C][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][Branch2][C][O][C][Ring2][Ring1][Ring1] | Cc1ccc2nc3n(c2c1)C(C4)COC3.c16ccc(C#N)cc1.N45.C56 |
1927866 | CC(=O)N1CCOCC(Oc2ccc(C(F)(F)F)cc2)C1 | [C][C][=Branch1][C][=O][N][C][C][O][C][C][Branch2][Ring1][Ring2][O][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][C][Ring2][Ring1][C] | N13CCOCC4C1.c15ccc6cc1.C6(F)(F)F.CC3=O.O45 |
1927867 | CC(C)C(=O)N1CCOCC(Oc2ccc(C(F)(F)F)cc2)C1 | [C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][O][C][C][Branch2][Ring1][Ring2][O][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][C][Ring2][Ring1][C] | N13CCOCC4C1.c15ccc6cc1.CC(C)C3=O.C6(F)(F)F.O45 |
1927868 | COc1ccc(CC(=O)N2CCOCC(Oc3cccnc3)C2)cc1 | [C][O][C][=C][C][=C][Branch2][Ring1][#Branch2][C][C][=Branch1][C][=O][N][C][C][O][C][C][Branch1][#Branch2][O][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring1][=C][C][=C][Ring2][Ring1][#Branch1] | N14CCOCC5C1.c16ccc8cc1.c17cccnc1.C8C4=O.CO6.O57 |
1927870 | CS(=O)(=O)N1CCOCC(Oc2ccc(C(F)(F)F)cc2)C1 | [C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][O][C][C][Branch2][Ring1][Ring2][O][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][C][Ring2][Ring1][C] | N15CCOCC3C1.c14ccc6cc1.CS5(=O)=O.C6(F)(F)F.O34 |
1927871 | COc1ccc(OC2COCCN(S(C)(=O)=O)C2)cc1 | [C][O][C][=C][C][=C][Branch2][Ring1][Branch1][O][C][C][O][C][C][N][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][Ring1][O][C][=C][Ring2][Ring1][C] | C13COCCN6C1.c14ccc5cc1.S6(C)(=O)=O.CO4.O35 |
1927872 | Cc1ncc(CO)c2cc(C(=O)c3ccc4c(c3)OCCO4)oc12 | [C][C][=N][C][=C][Branch1][Ring1][C][O][C][C][=C][Branch2][Ring1][Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][O][Ring1][#Branch1][O][C][Ring2][Ring1][#Branch1][=Ring1][P] | Cc1ncc7c2cc5oc12.c16ccc2c(c1)OCCO2.C56=O.C7O |
1927873 | CC(C)n1cc(CC(=O)NCC(=O)c2ccccc2)c2ccccc21 | [C][C][Branch1][C][C][N][C][=C][Branch2][Ring1][Ring2][C][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][=Branch1] | n16cc7c2ccccc21.c15ccccc1.C7C3=O.C4C5=O.CC6C.N34 |
1927874 | COc1cc2cc(C(=O)NC3CCOC(C)(C)C3)n(C)c2cc1OC | [C][O][C][=C][C][C][=C][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][C][O][C][Branch1][C][C][Branch1][C][C][C][Ring1][Branch2][N][Branch1][C][C][C][=Ring1][P][C][=C][Ring2][Ring1][Branch1][O][C] | c15cc2cc8n(C)c2cc16.C17CCOC(C)(C)C1.C48=O.CO5.N47.O6C |
1927875 | O=C(CC1NC(=O)c2ccccc2NC1=O)NCCc1ccccn1 | [O][=C][Branch2][Ring1][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][Ring1][N][=O][N][C][C][C][=C][C][=C][C][=N][Ring1][=Branch1] | C15NC(=O)c2ccccc2NC1=O.c16ccccn1.O=C3C5.C4C6.N34 |
1927876 | Cc1cc2c(c(=O)[nH]1)C(c1cc3cccc(C)c3[nH]c1=O)CC(=O)O2 | [C][C][=C][C][=C][Branch1][Branch2][C][=Branch1][C][=O][NH1][Ring1][#Branch1][C][Branch2][Ring1][Ring1][C][=C][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][NH1][C][Ring1][O][=O][C][C][=Branch1][C][=O][O][Ring2][Ring1][=Branch1] | Cc1cc2c(c(=O)[nH]1)C(c1cc3cccc(C)c3[nH]c1=O)CC(=O)O2 |
1927877 | Cc1nc2ncccc2c(=O)n1CCNC(=O)c1ccc2[nH]ccc2c1 | [C][C][=N][C][=N][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Ring1][O][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][NH1][C][=C][C][Ring1][Branch1][=C][Ring1][=Branch2] | Cc1nc2ncccc2c(=O)n16.c15ccc2[nH]ccc2c1.C6C4.C35=O.N34 |
1927878 | COc1cc2c(cc1OC)CC(=O)N(C(C)C(C)=O)C=C2 | [C][O][C][=C][C][=C][Branch1][#Branch1][C][=C][Ring1][=Branch1][O][C][C][C][=Branch1][C][=O][N][Branch1][#Branch2][C][Branch1][C][C][C][Branch1][C][C][=O][C][=C][Ring1][P] | c13cc2c(cc14)CC(=O)N5C=C2.C5(C)C(C)=O.CO3.O4C |
1927879 | CC(=O)Nc1cccc2c1ccn2CC(=O)NCCc1ccccc1 | [C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][N][Ring1][Branch1][C][C][=Branch1][C][=O][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1] | c16cccc2c1ccn27.c18ccccc1.C7C4=O.CC3=O.C5C8.N36.N45 |
1927880 | Cc1ccc2cc(C3CC(=O)Oc4cc(C)[nH]c(=O)c43)c(=O)[nH]c2c1 | [C][C][=C][C][=C][C][=C][Branch2][Ring1][Branch2][C][C][C][=Branch1][C][=O][O][C][C][=C][Branch1][C][C][NH1][C][=Branch1][C][=O][C][=Ring1][Branch2][Ring1][=N][C][=Branch1][C][=O][NH1][C][Ring2][Ring1][Ring2][=C][Ring2][Ring1][Branch2] | Cc1ccc2cc(C3CC(=O)Oc4cc(C)[nH]c(=O)c43)c(=O)[nH]c2c1 |
1927881 | O=C(c1cccc2[nH]ccc12)N1CC2CC(C1)c1cccc(=O)n1C2 | [O][=C][Branch1][=C][C][=C][C][=C][C][NH1][C][=C][C][Ring1][=Branch2][=Ring1][Branch1][N][C][C][C][C][Branch1][Ring2][C][Ring1][=Branch1][C][=C][C][=C][C][=Branch1][C][=O][N][Ring1][#Branch1][C][Ring1][N] | N13CC2CC(C1)c1cccc(=O)n1C2.c14cccc2[nH]ccc12.O=C34 |
1927882 | COc1cc2c(cc1OC)CC(=O)N(CC(=O)NCCC(C)C)C=C2 | [C][O][C][=C][C][=C][Branch1][#Branch1][C][=C][Ring1][=Branch1][O][C][C][C][=Branch1][C][=O][N][Branch1][=C][C][C][=Branch1][C][=O][N][C][C][C][Branch1][C][C][C][C][=C][Ring2][Ring1][Branch1] | c14cc2c(cc15)CC(=O)N7C=C2.C6CC(C)C.C7C3=O.CO4.O5C.N36 |
1927883 | CC(C)C1CC(=O)Nc2ccc3nn(-c4ccccc4)nc3c21 | [C][C][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][C][=C][C][=N][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=C][Ring1][O][C][=Ring1][#C][Ring2][Ring1][Ring2] | CC(C)C1CC(=O)Nc2ccc3nn5nc3c21.c15ccccc1 |
1927884 | Cc1nn(C(C)C)c(C)c1NC(=O)c1cc(-c2cccnc2)n[nH]1 | [C][C][=N][N][Branch1][=Branch1][C][Branch1][C][C][C][C][Branch1][C][C][=C][Ring1][=Branch2][N][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][=N][NH1][Ring1][O] | Cc1nn6c(C)c14.c15cc7n[nH]1.c17cccnc1.C6(C)C.C35=O.N34 |
1927885 | O=C(NCCc1nc2ccccc2[nH]1)c1csc(NC2CC2)n1 | [O][=C][Branch1][P][N][C][C][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][=Branch2][C][=C][S][C][Branch1][#Branch1][N][C][C][C][Ring1][Ring1][=N][Ring1][=Branch2] | c18nc2ccccc2[nH]1.c17csc5n1.O=C37.C4C8.C16CC1.N34.N56 |
1927886 | CC(=O)Nc1cccc2c1ccn2CC(=O)Nc1ccc(F)cc1 | [C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][N][Ring1][Branch1][C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1] | c15cccc2c1ccn27.c16ccc(F)cc1.C7C4=O.CC3=O.N35.N46 |
1927887 | O=C(Cc1ccc(-n2cnnn2)cc1)Nc1cccc2[nH]ccc12 | [O][=C][Branch2][Ring1][Ring1][C][C][=C][C][=C][Branch1][Branch2][N][C][=N][N][=N][Ring1][Branch1][C][=C][Ring1][O][N][C][=C][C][=C][C][NH1][C][=C][C][Ring1][=Branch2][=Ring1][Branch1] | c14cccc2[nH]ccc12.c15ccc6cc1.n16cnnn1.O=C3C5.N34 |
1927889 | CC(=O)Nc1cccc2c1ccn2CC(=O)N1CCCC1 | [C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][N][Ring1][Branch1][C][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1] | c15cccc2c1ccn26.N14CCCC1.C6C4=O.CC3=O.N35 |
1927893 | COc1cccc(NC(=O)Cn2ccc3c(NC(C)=O)cccc32)c1 | [C][O][C][=C][C][=C][C][Branch2][Ring1][N][N][C][=Branch1][C][=O][C][N][C][=C][C][=C][Branch1][#Branch1][N][C][Branch1][C][C][=O][C][=C][C][=C][Ring1][#Branch2][Ring1][=N][=C][Ring2][Ring1][#Branch1] | n19ccc2c8cccc21.c16cccc7c1.C4(=O)C9.C5(C)=O.CO6.N47.N58 |
1927894 | CC(C)n1cc(CC(=O)NCc2nc3ccccc3[nH]2)c2ccccc21 | [C][C][Branch1][C][C][N][C][=C][Branch2][Ring1][Branch1][C][C][=Branch1][C][=O][N][C][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][#Branch1] | n16cc8c2ccccc21.c17nc2ccccc2[nH]1.C8C4=O.CC6C.N45.C57 |
1927895 | O=C(Cc1ccc(-n2cnnn2)cc1)NCCSc1ccccc1 | [O][=C][Branch2][Ring1][Ring1][C][C][=C][C][=C][Branch1][Branch2][N][C][=N][N][=N][Ring1][Branch1][C][=C][Ring1][O][N][C][C][S][C][=C][C][=C][C][=C][Ring1][=Branch1] | c16ccc7cc1.c18ccccc1.n17cnnn1.O=C3C6.C4C5.N34.S58 |
1927896 | O=C(CNC(=O)c1cnccn1)NCCc1nc2ccccc2[nH]1 | [O][=C][Branch1][#C][C][N][C][=Branch1][C][=O][C][=C][N][=C][C][=N][Ring1][=Branch1][N][C][C][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][=Branch2] | c18nc2ccccc2[nH]1.c17cnccn1.O=C3C5.C47=O.C6C8.N45.N36 |
1927897 | COc1ccc(NC(=O)Cn2ccc3c(NC(C)=O)cccc32)cc1 | [C][O][C][=C][C][=C][Branch2][Ring1][N][N][C][=Branch1][C][=O][C][N][C][=C][C][=C][Branch1][#Branch1][N][C][Branch1][C][C][=O][C][=C][C][=C][Ring1][#Branch2][Ring1][=N][C][=C][Ring2][Ring1][#Branch1] | n19ccc2c8cccc21.c16ccc7cc1.C4(=O)C9.C5(C)=O.CO6.N47.N58 |
1927898 | Cc1nn(C)c(C)c1NC(=O)Cn1c(C)nc2ccc(F)cc2c1=O | [C][C][=N][N][Branch1][C][C][C][Branch1][C][C][=C][Ring1][#Branch1][N][C][=Branch1][C][=O][C][N][C][Branch1][C][C][=N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][Ring1][N][=O] | n15c(C)nc2ccc(F)cc2c1=O.Cc1nn(C)c(C)c14.C3(=O)C5.N34 |
1927899 | O=C(NCCc1ccccn1)c1cc(-c2ccc3c(c2)CCO3)n[nH]1 | [O][=C][Branch1][N][N][C][C][C][=C][C][=C][C][=N][Ring1][=Branch1][C][=C][C][Branch1][S][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][O][Ring1][=Branch1][=N][NH1][Ring1][=C] | c18ccc2c(c1)CCO2.c17ccccn1.c16cc8n[nH]1.O=C46.C5C7.N45 |
1927900 | Cn1cc(NC(=O)c2cc(-c3cccnc3)n[nH]2)cn1 | [C][N][C][=C][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][=N][NH1][Ring1][O][C][=N][Ring2][Ring1][Ring1] | Cn1cc5cn1.c16cc7n[nH]1.c17cccnc1.C46=O.N45 |
1927901 | CC(=O)Nc1cccc2c1ccn2CC(=O)Nc1cccc(Cl)c1 | [C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][N][Ring1][Branch1][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1] | c15cccc2c1ccn27.c16cccc(Cl)c1.C7C4=O.CC3=O.N35.N46 |
1927902 | O=C(NCCn1ccc2ccccc21)C(c1ccccc1)n1cnnn1 | [O][=C][Branch1][P][N][C][C][N][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=Branch2][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=N][N][=N][Ring1][Branch1] | n15ccc2ccccc21.c17ccccc1.O=C3C67.n16cnnn1.C4C5.N34 |
1927903 | Cn1nnc(-c2cccc(NC(=O)c3cc(-c4cccnc4)n[nH]3)c2)n1 | [C][N][N][=N][C][Branch2][Ring2][Ring1][C][=C][C][=C][C][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][=N][NH1][Ring1][O][=C][Ring2][Ring1][Ring2][=N][Ring2][Ring1][=Branch2] | c18cccc6c1.Cn1nnc8n1.c17cc9n[nH]1.c19cccnc1.C57=O.N56 |
1927905 | O=C(Cc1ccc(-n2cnnn2)cc1)NCc1ccccn1 | [O][=C][Branch2][Ring1][Ring1][C][C][=C][C][=C][Branch1][Branch2][N][C][=N][N][=N][Ring1][Branch1][C][=C][Ring1][O][N][C][C][=C][C][=C][C][=N][Ring1][=Branch1] | c16ccc7cc1.c15ccccn1.n17cnnn1.O=C3C6.N34.C45 |
1927906 | Cn1cnc2cc(NC(=O)CCCc3nnc4ccccn34)ccc21 | [C][N][C][=N][C][=C][C][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][C][C][=N][N][=C][C][=C][C][=C][N][Ring1][=Branch2][Ring1][=Branch1][=C][C][=C][Ring2][Ring1][Branch1][Ring2][Ring1][Branch2] | Cn1cnc2cc6ccc21.c17nnc2ccccn12.C5(=O)CCC7.N56 |
1927907 | COc1ccccc1NC(=O)Cn1ccc2c(NC(C)=O)cccc21 | [C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][N][C][=C][C][=C][Branch1][#Branch1][N][C][Branch1][C][C][=O][C][=C][C][=C][Ring1][#Branch2][Ring1][=N] | n18ccc2c7cccc21.c15ccccc16.C3(=O)C8.C4(C)=O.CO5.N36.N47 |
1927909 | O=C(N=c1[nH]cc[nH]1)c1cc(-c2ccc3c(c2)CCO3)n[nH]1 | [O][=C][Branch1][=Branch2][N][=C][NH1][C][=C][NH1][Ring1][Branch1][C][=C][C][Branch1][S][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][O][Ring1][=Branch1][=N][NH1][Ring1][=C] | c15ccc2c(c1)CCO2.O=C4N=c1[nH]cc[nH]1.c14cc5n[nH]1 |
1927910 | CC(NC(=O)Cc1ccc2c(c1)OCC2)c1nc2ccccc2[nH]1 | [C][C][Branch2][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][Ring1][=Branch1][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][=Branch2] | c16ccc2c(c1)OCC2.c15nc2ccccc2[nH]1.C3(=O)C6.CC45.N34 |
1927911 | O=C(Nc1nc2c(s1)CCC2)c1cc(-c2cccs2)n[nH]1 | [O][=C][Branch1][S][N][C][=N][C][=C][Branch1][Ring2][S][Ring1][Branch1][C][C][C][Ring1][=Branch1][C][=C][C][Branch1][Branch2][C][=C][C][=C][S][Ring1][Branch1][=N][NH1][Ring1][#Branch2] | c14nc2c(s1)CCC2.c15cc6n[nH]1.c16cccs1.O=C35.N34 |
1927912 | COc1ccc(NC(=O)CN2Cc3ccccc3C2=O)cn1 | [C][O][C][=C][C][=C][Branch2][Ring1][Branch1][N][C][=Branch1][C][=O][C][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=Branch2][=O][C][=N][Ring2][Ring1][Ring2] | N17Cc2ccccc2C1=O.c15ccc6cn1.C4(=O)C7.CO5.N46 |
1927913 | CC(NC(=O)c1ccc2c(c1)OCCCO2)c1nc2ccccc2[nH]1 | [C][C][Branch2][Ring1][#Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][O][Ring1][Branch2][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][Ring1][=Branch2] | c15ccc2c(c1)OCCCO2.c16nc2ccccc2[nH]1.CC46.C35=O.N34 |
1927914 | CC(=O)Nc1cccc2c1ccn2CC(=O)Nc1ccccc1 | [C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][N][Ring1][Branch1][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1] | c15cccc2c1ccn27.c16ccccc1.C7C4=O.CC3=O.N35.N46 |
1927915 | CC(=O)Nc1cccc2c1ccn2CC(=O)Nc1ccccc1Cl | [C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][N][Ring1][Branch1][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl] | c15cccc2c1ccn27.c16ccccc1Cl.C7C4=O.CC3=O.N35.N46 |
1927916 | O=C(c1ccsc1)N1CCCC(c2nnc(-c3ccsc3)o2)C1 | [O][=C][Branch1][Branch2][C][C][=C][S][C][=Ring1][Branch1][N][C][C][C][C][Branch1][P][C][=N][N][=C][Branch1][Branch2][C][C][=C][S][C][=Ring1][Branch1][O][Ring1][#Branch2][C][Ring1][S] | N14CCCC6C1.c16nnc7o1.c15ccsc1.c17ccsc1.O=C45 |
1927917 | O=c1n(Cc2ccccc2Cl)nc(-c2ccco2)n1C1CC1 | [O][=C][N][Branch1][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][N][=C][Branch1][Branch2][C][=C][C][=C][O][Ring1][Branch1][N][Ring2][Ring1][C][C][C][C][Ring1][Ring1] | O=c1n3nc6n15.c14ccccc1Cl.c16ccco1.C15CC1.C34 |
1927919 | N#Cc1ccccc1Cn1nc(-c2ccco2)n(C2CC2)c1=O | [N][#C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][N][=C][Branch1][Branch2][C][=C][C][=C][O][Ring1][Branch1][N][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Ring1][=N][=O] | N#Cc1ccccc14.n13nc6n5c1=O.c16ccco1.C15CC1.C34 |
1927920 | COc1cccc(Cn2nc(-c3ccco3)n(C3CC3)c2=O)c1 | [C][O][C][=C][C][=C][C][Branch2][Ring1][#Branch2][C][N][N][=C][Branch1][Branch2][C][=C][C][=C][O][Ring1][Branch1][N][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Ring1][=N][=O][=C][Ring2][Ring1][Branch1] | n15nc8n7c1=O.c14cccc6c1.c18ccco1.C17CC1.CO4.C56 |
1927921 | O=c1n(Cc2ccc(F)cc2)nc(-c2ccco2)n1C1CC1 | [O][=C][N][Branch1][=N][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][N][=C][Branch1][Branch2][C][=C][C][=C][O][Ring1][Branch1][N][Ring2][Ring1][C][C][C][C][Ring1][Ring1] | O=c1n3nc6n15.c14ccc(F)cc1.c16ccco1.C15CC1.C34 |
1927922 | COC(=O)c1ccc(Cn2nc(-c3ccco3)n(C3CC3)c2=O)cc1 | [C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Ring1][#Branch2][C][N][N][=C][Branch1][Branch2][C][=C][C][=C][O][Ring1][Branch1][N][Branch1][=Branch1][C][C][C][Ring1][Ring1][C][Ring1][=N][=O][C][=C][Ring2][Ring1][Branch1] | n16nc9n8c1=O.c15ccc7cc1.c19ccco1.C45=O.C18CC1.CO4.C67 |
1927923 | O=C(NCCn1cnc(C2CCCC2)cc1=O)NCc1cccs1 | [O][=C][Branch2][Ring1][=Branch1][N][C][C][N][C][=N][C][Branch1][Branch2][C][C][C][C][C][Ring1][Branch1][=C][C][Ring1][O][=O][N][C][C][=C][C][=C][S][Ring1][Branch1] | n17cnc9cc1=O.C19CCCC1.c18cccs1.O=C34.C5C7.N35.N46.C68 |
1927924 | Cc1nc(-c2ccco2)sc1CNC(=O)NC(C)(C)C | [C][C][N][=C][Branch1][Branch2][C][=C][C][=C][O][Ring1][Branch1][S][C][=Ring1][#Branch2][C][N][C][=Branch1][C][=O][N][C][Branch1][C][C][Branch1][C][C][C] | Cc1nc8sc17.c18ccco1.C6(C)(C)C.C34=O.C57.N35.N46 |
1927925 | N#Cc1cccnc1OC1CCN(C(=O)c2ccc(=O)[nH]c2)CC1 | [N][#C][C][=C][C][=C][N][=C][Ring1][=Branch1][O][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C][C][=C][C][=Branch1][C][=O][NH1][C][=Ring1][#Branch1][C][C][Ring1][#C] | N#Cc1cccnc14.C15CCN3CC1.c16ccc(=O)[nH]c1.C36=O.O45 |
1927926 | Cc1nc(C(=O)N2CCC(Oc3ncccc3C#N)CC2)cs1 | [C][C][=N][C][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C][C][Branch1][N][O][C][=N][C][=C][C][=C][Ring1][=Branch1][C][#N][C][C][Ring1][#C][=C][S][Ring2][Ring1][=Branch1] | c15ncccc1C#N.N14CCC6CC1.Cc1nc7cs1.C47=O.O56 |
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