Molecule_ID stringlengths 13 41 | SMILES stringlengths 18 204 ⌀ | InChI_Key stringlengths 27 27 ⌀ |
|---|---|---|
00A0B17624716197_FB55D56B5E6E42C5_6041_UN | NN4C=NC1=C(C=C(C=C1)NCC2=C(C)C3=C(O2)C=CC=C3)C4=O | ZBMGEDYONNIGPE-UHFFFAOYSA-N |
00B485C544F82D8C_565C0D18A9E16A54_6041_UN | C2(=C1CCCC1=NC(=N2)C3CC3)NC4=CC(=C(OCCN(C)C)C=C4)F | YCUXCFHGHICKFT-UHFFFAOYSA-N |
01B30B5D9C797B6F_863A99FF8FEC6E96_6038_UN | CN1C(=O)OC2=C1C=CC(=C2)CNC(=O)C3=COC(=C3)C4=CSC=C4 | JUTWFZVUXJWMCS-UHFFFAOYSA-N |
044D2247FC10D86C_C940C5B0A1726F42_6041_UN | CC(C)OC1=NC(=C(C=C1)NCC2=CC(=C(C)C=C2)[N](=O)=O)C#N | WYAJTNSEEVFVRS-UHFFFAOYSA-N |
05E04233EF1BA440_1781C8D824886C82_6034_UN | N#[N]=NCC2=NC1=C(C=CC=C1)N2C3=CNC(=CC3=O)C | KXFWNPFTKYOTND-UHFFFAOYSA-N |
0A235759FD62F196_03093E23EDE2ABD8_6026_UN | CC(C)C1=NC(=C[NH]1)[S](=O)(=O)NCC2=CC=C(C=C2)N3CC=CC3 | COFASFZRSUYMFQ-UHFFFAOYSA-N |
0A8B910974EE5087_20E71EAC818E0888_6041_UN | O=[N](=O)C1=C(C2=C(N=C1)C=CC(=C2)F)NC[C@H]4[C@H](C3=NC=C[N]3C)OCCC4 | IIQZDZPSNWBIMY-KPZWWZAWSA-N |
0AFB518652232363_A3F92B7762EC7903_6038_UN | COC1=C(C=CC=C1)C(CNC(=O)C2=C(C=CC(=C2)[S](=O)(=O)C3CCCC3)F)N4CCCCC4 | KKDLEQICKUKASV-UHFFFAOYSA-N |
0B58BF961B96691B_8C8BBD182D8E978F_6038_UN | C[N]1N=C(C(=C1)NC(C3=C2C=CC=CC2=C(C)C=C3)=O)N | FQYUHINMQDZZCA-UHFFFAOYSA-N |
0E937EB4898D9771_8272F2A6CDD2631E_6038_UN | CN1C(=O)OC2=C1C=CC(=C2)CNC(=O)C3=CC=C(C#N)S3 | WRWKNEPUWUGJIE-UHFFFAOYSA-N |
0FF57ECB178B8FBC_847200BCA6D74B46_6041_DP | N2CC[C@@H]1CN(C[C@@H]1C2)C3=NC=C(N=C3)NCC4(N(C)C)CCOCC4 | KGXVAVSKOYJCET-CVEARBPZSA-N |
108EF5BB9608230A_0665FCD083B160D9_6038_UN | N[S](=O)(=O)C1=C(C=CC(=C1)F)OC(=O)C3=C[N]2CCCCC2=C3 | RKQABCTZHNZFFG-UHFFFAOYSA-N |
10D210581E99CAB9_D1951FF8B13ABAE7_6038_UN | N(C1=CC(=CC=C1)C2=CC3=C(C=C2)OCC3)C(C4=CN(C(=CC4=O)C)C)=O | MPSPQMQZZRBVFT-UHFFFAOYSA-N |
11910FCCBAC6842E_ABE256C14C8EBFA9_6038_UN | S(CC1=CC=C[NH]1)C(CCN2C(C(=C(C)C2=O)C)=O)=O | UDZIHUGIUONWJT-UHFFFAOYSA-N |
13D64D899C066DBE_F73537A414F37FDA_6026_UN | CC1=C(C=CC=C1)[N]2C=C(C=N2)[S](=O)(=O)NCC3=C(C=CC=C3)CN4CCCCC4 | LUVOQHXLNKASLK-UHFFFAOYSA-N |
167C15BD2D23555C_5AD85E64EDC5AF72_6029_DP | N2CCC1=C(C=CC=C1)C2CN[S](C4=C3OCOC3=CC=C4)(=O)=O | CDSUYRUEIUKSOG-UHFFFAOYSA-N |
17C0051CBEFF9856_BE6F2100FC5C3951_6039_UN | COC(=O)C(C)(C)COCC(NC1=C(C(OC)=O)SC=C1)=O | JLAKGIJNRAFNSV-UHFFFAOYSA-N |
1A0F2498EEEDA276_65F11FFF1E5B1F0E_6004_UN | C1(=CC2=C(C=C1)C(=O)OC2)C3=C(OC)C(=CC(=C3)C)C | SSRMFRSQHNWHRZ-UHFFFAOYSA-N |
1B8AB1383A7DA3AA_6D7C0894AB8291D4_6041_UN | C1(=NC=C(C=C1)CN2CCOCC2)NC3=C(C=CC(=C3)[S](=O)(=O)N4CCCCC4)N5CCOCC5 | NNZKVQRMYONHLL-UHFFFAOYSA-N |
1C4F490FAD2625A3_9A150514D96AAA22_6026_UN | CC1=C(C=N[NH]1)[S](=O)(=O)NCC2=CC(=CC=C2)C3CC3 | XCEZCAXVSIYBSW-UHFFFAOYSA-N |
1E2B7C61C5560E96_05070843CFE88785_6038_UN | C[N]1C=CC(=N1)N4CCC(NC(C3=CN=C(N2CCN(C)CC2)S3)=O)C4 | BKLXVFFEAHKDAZ-UHFFFAOYSA-N |
1FD386FC574E7BC4_040FB27F37E340AF_6038_UN | CCON3CCC(NC(=O)C2=CC1=C(C=CC(=C1Cl)F)[NH]2)CC3 | IDWWAPGFKMAXEU-UHFFFAOYSA-N |
1FFE34A993A955BD_8E6574F6EB26DC04_6026_DP | CC1=CC=C(C=C1)[N]2C=C(C=N2)[S](=O)(=O)NC3C4=C(CCNC3)C=CC=C4 | KBHWFFIFUMRWPP-UHFFFAOYSA-N |
21A826475EE0802B_830341F65CB1CACA_6034_UN | CC2=C1N=C(N(C1=CC=C2)CCN3C=C(N)C=CC3=O)N | SXDXOKKKEUGFLF-UHFFFAOYSA-N |
22B1331785BCE849_92E2E9FA7E0575D4_6038_UN | CC1=CC=C(C=C1)C2=NC(=CO2)CCNC(=O)C3=CC(=C[NH]3)[S](=O)(=O)N4CCOCC4 | IPNVFGFVQCFYLD-UHFFFAOYSA-N |
23B758DA613D3D53_B0C97B4C411D3211_6038_UN | COC(=O)C(C)(C)CNC(C1=C[NH]C(=C1)C(OC)=O)=O | GMGNVVPSTLKVRP-UHFFFAOYSA-N |
2504C7CCC7688C9C_E1EBBF1EEBF30205_7017_UN | CC2=C1C=CC=C(C1=CC=N2)[S](=O)(=O)N4C(C3=NC=C[N]3C)CC(N)CC4 | UAOILIYQQAHEDO-UHFFFAOYSA-N |
280BECFF67A673A7_65068A765C2A66C7_6041_UN | CCOC(=O)C(C)(C#N)C1=C(C=CC=N1)NCC(CC(OC)=O)(C)C | LZDLRXRVYARAJC-UHFFFAOYSA-N |
2AD92D8DE357A1ED_B26B66993CFAB201_6004_UN | C1(=CC2=C(C=C1)C(=O)OC(=O)C2)C3=CC(=C(OC)C=C3)F | UVFJPAABDYKAER-UHFFFAOYSA-N |
2CAEA92692528620_F3861E2A1D5CB2A9_6026_DP | CC1=C(C2=C(C=C1)C=CC=N2)[S](=O)(=O)NCC4=C(C3CNC3)OC=N4 | YTOGHUCOEFEPKP-UHFFFAOYSA-N |
2EE358133C38E4DD_7F8F060F47E41EAA_6026_DP | [S](=O)(=O)(C1=CC2=C(C=C1)C=CC=N2)NCC4=C(C3CNC3)OC=N4 | TWJAJAUFSCDHBJ-UHFFFAOYSA-N |
2F2504947FCCADB8_EB8EA63EEBC21D66_6038_DP | COC1=CC(=C(C=C1)COC(C3=CC2=C(NCC2)C=C3)=O)OC | IXBYVFUFMVAWJK-UHFFFAOYSA-N |
31F02CB6AECA3B57_5ADD59950B31194B_6038_UN | CN1C(=O)OC2=C1C=CC(=C2)CNC(=O)C4=CC3=CSC=C3S4 | PHFOJMRBXJMZCD-UHFFFAOYSA-N |
329487E532871E6C_745EF775C3677FC2_6026_UN | CC1=C(C=CC=C1)[N]2C=C(C=N2)[S](=O)(=O)NCC3=C(C=CC=C3)CN4CCCC4 | XNPJRDZHAYPRSP-UHFFFAOYSA-N |
342701EF67BC6734_2E8CC01D4BE841E0_6026_UN | C[N]1C=C([N](=O)=O)C(=N1)[S](=O)(=O)NCC2C(F)(F)C23CCC3 | WQJBWHBGYGFDII-UHFFFAOYSA-N |
3538BB4FC5615DE5_63807E65A13053E2_6029_UN | COC1=C(C=C(C=C1)CN[S](C2=CC=CC3=C(O)C=CC=C23)(=O)=O)OC | CICZBQGVPSMXIR-UHFFFAOYSA-N |
36FC21598D7A068A_47DC7F7C5F337538_7017_UN | CC2=C1C=CC=C(C1=CC=N2)[S](=O)(=O)N4CCC(C3=CC(=N[NH]3)N)CC4 | ZHBOQLMXNXAAAU-UHFFFAOYSA-N |
3700B99BE08B6E3A_B0959525E196E07E_6041_UN | CC2=C1C(=NC=CC1=CC=C2)NC3=C(C=CC(=C3)[S](=O)(=O)N4CCOCC4)N5CCOCC5 | FVSYABOOTQGHTL-UHFFFAOYSA-N |
371D94384EC0FC8D_B8022E3F7108A69E_6038_UN | N(C1CCN(CC1)[S](=O)(=O)N2CCOCC2)C(C3=CC=CC(=C3)CSC4=NC=C[N]4C)=O | ARLZWNLLVQWKOQ-UHFFFAOYSA-N |
397B1F8FFF94DC9B_8D4F2CCF8D80F04F_6041_UN | NN3C=NC1=C(C=C(C=C1)NCC2=C(C)C=CC=C2)C3=O | HJWJBFCQKBLBKK-UHFFFAOYSA-N |
3CC4ADAD7C25D1B8_9A33EF4036C6440C_6041_UN | NN4C=NC1=C(C=C(C=C1)NC2=CC=C(C=C2)C3=NC=CC=C3)C4=O | HZMCUCONEXIATP-UHFFFAOYSA-N |
3F8861FD596A46E3_B847EFA688336098_6004_UN | C1(=CC2=C(C=C1)C(=O)OC(=O)C2)C3=C(OC)C=CC=C3F | LTWGXSUXPXSYPB-UHFFFAOYSA-N |
3FAB61A4EA1DF5E0_95B19280BC923D29_6038_UN | COC1=C(C=CC(=N1)C(=O)N)NC(=O)C2=CC=C(C=C2)[S](=O)(=O)N3CCCCCC3 | KHLDEOOCPDIJMQ-UHFFFAOYSA-N |
410A4DE70D8CD057_89425242B822F2A0_7017_UN | CC2=C1C=CC=C(C1=CC=N2)[S](=O)(=O)N4CCC(C3=NOC(=C3C)N)CC4 | MJSRJBMEBMPOFC-UHFFFAOYSA-N |
4146D4F26D40BD9F_62040ECF269DD365_6026_UN | FC1=C(C=CC(=C1)C2OCCO2)[S](=O)(=O)N4CCN(C3=NC=CC(=C3)C#N)CC4 | YOPBXLQXLMNHRX-UHFFFAOYSA-N |
4252120C90701C9E_171A4CC7B22376BF_6041_UN | NN4C=NC1=C(C=C(C=C1)NCC2=CC(=NC=C2)C3=CC=CC=C3)C4=O | ZGLSMCRBLQVJCU-UHFFFAOYSA-N |
4412C7E410EC81F3_BF1C0355034F4C13_7017_UN | CC1=C(C=C(C(=C1)[S](=O)(=O)N3CCC(C2=CC(=NC=C2)N)C3)C)N | YPPXBLVZHZRBGQ-UHFFFAOYSA-N |
44E556965AC9A6E7_29E0962DC3E1A4B9_6026_UN | CC(C)C1=NC(=C[NH]1)[S](=O)(=O)NCC2=CC(=CC=C2)N3CC=CC3 | OPPGTDKGDAVJEZ-UHFFFAOYSA-N |
471C102C4F06840E_0F57C066238A217B_6038_UN | N(C1=CC=C(C=C1)CN2CCSCC2)C(C4=CC=C([S](N3CCC(C)CC3)(=O)=O)S4)=O | MQNMFYYVZIJXLE-UHFFFAOYSA-N |
4738704EC1CBA49E_5A15CC1DDCDCBDC1_6041_UN | C1(=C(C=CC=N1)C(=O)N2CCCC2)NCC3=C(C)C=CC=C3C | DUCIRFSRUNLCJS-UHFFFAOYSA-N |
47668BAD453D3415_C3FC1B7D5D2163EB_6041_UN | OC(=O)COC1=C(C=C(C=C1)NC2=C(C=C(OC)C=C2)OC)C3CCCCC3 | DVCCWKJEDYZYPE-UHFFFAOYSA-N |
4808C3A999036ED1_DEB087B3DBBFEAA5_6026_UN | CC1=C(N=C[NH]1)[S](=O)(=O)NCC2=CC(=CC=C2)C3CC3 | XZGCPZCSGQISPF-UHFFFAOYSA-N |
483B3F310FCF2C6D_0974401C9F2B3226_6026_DP | [S](=O)(=O)(C2=C1C=CC=NC1=CC=C2)NCC4=C(C3CNC3)OC=N4 | LCKOCBHZWZFNLM-UHFFFAOYSA-N |
48F00C6E88977313_B9730E53D3611A4D_6031_UN | CC1=C(SC(=N1)SCC(=C)Cl)CC(=O)OCC2(CN(C)C)CCC2 | LOYVEXCIUDGGEU-UHFFFAOYSA-N |
4A08A47AB817F2F5_DE00A0D112A5D5F2_6041_DP | SC3=NN=C(C1=CC(=CC=C1)[S](=O)(=O)N2CCOCC2)[N]3C4=CC(=CC=C4)NC5C6(NCC5)CC6 | BYXSXXMVEFITLN-UHFFFAOYSA-N |
4DAC24E35D6FE1C9_7A625509198E97BC_6026_UN | CC1=C(C=N[NH]1)[S](=O)(=O)NCC2=C(C=CC=C2)C3CC3 | BQNJGLSKPQDGAN-UHFFFAOYSA-N |
50D503CD877BD98C_4C43C7B02A3F2EFD_6029_DP | N(CC1=C2C(=CC=C1)OCCO2)[S](C3=CC4=C(C=C3)CNCC4)(=O)=O | BDCGVSSKRDCKOB-UHFFFAOYSA-N |
51493C56C0795C14_737CFCB87EBFF827_6039_UN | CC(=CCOCC(C(C(OCC)=O)=NNC1=C(C=CC=C1)OC)=O)C | VZPVXVUIVSFZJJ-UHFFFAOYSA-N |
51BBBBEED453F27B_26B38265D921ED4E_6041_UN | O=[N](=O)C1=CC(=C(N=C1)NC4(CN2CCN(CC2)C3=NC=CC=N3)CC4)F | YEMZSQDPGXWPTB-UHFFFAOYSA-N |
528AC0F370FDA49C_5A73E744B72C618F_6035_UN | O(C1(CCNCC1)C2=C(C=CC=C2F)F)C3=CC=C(C=C3)O[S](=O)(=O)O | BISNROQEGQOUIW-UHFFFAOYSA-N |
57D615967A1D1355_808F083F3FD6B7AE_6026_UN | CC1=CC(=CC(=C1)C2=CC=CC=C2)[S](=O)(=O)NC4CCN(C3CCN(C)CC3)CC4 | QONBLXJHPXVZBJ-UHFFFAOYSA-N |
58BCCCC89512F17F_6CE5FBA831F65ED5_6041_UN | O=[N](=O)C2=C1N=CC=CC1=CC(=C2)NCC3(CCC3)C4=C(C=CC=C4F)F | ZFBYITNRBCJTDV-UHFFFAOYSA-N |
5B0F68926FE2B0F7_76EB5E02D3852DA9_6026_UN | COC1=C(C=C(C=N1)[S](=O)(=O)N3CCC(OC2=CC=CC(=C2C)C)CC3)C | XCHXQOIRQYDPBL-UHFFFAOYSA-N |
5B1A2250355DCAF9_2F5C8490A249BC63_6026_DP | [S](=O)(=O)(C1=CC2=C(C=C1)C=CC=C2)NCC4=C(C3CNC3)OC=N4 | ULYRTQCUCCGANV-UHFFFAOYSA-N |
5B1F3A0489692E89_B6C078C0B46C15DD_6041_UN | C1(=NC=C(C=C1)CN2CCOCC2)NCC3=CC=C(S3)[S](=O)(=O)N4CCCC4 | FITRNELCATZWEL-UHFFFAOYSA-N |
5E98D439E3E4C103_A8C024B64A5C54C3_6038_UN | CC2=C1C=CC(=CC1=NC(=C2)N)OC(C3=CC(=C(C(=C3)C)C)[S](N4CCC(C)CC4)(=O)=O)=O | OFFSHOWXEBXPMK-UHFFFAOYSA-N |
5F843961C34CB28B_1173E2BB8040F119_6038_UN | N(CCC1=CC2=C(C=C1)C=N[NH]2)C(=O)CN4C=CC3=C(C=CC=C3)C4=O | XBBZCUNVRQSIKN-UHFFFAOYSA-N |
60441055389F1627_9D13BB62E2CAFE16_6041_UN | O=[N](=O)C2=C1N=C(C=CC1=CC(=C2)F)NC3CCC(CC3)OC4=NC=C(C=C4)C#N | DZBQXUYWIUUPRS-UHFFFAOYSA-N |
611C176CBF9BF8F4_DC2D48102FEDBEDA_6034_UN | O=[N](=O)C=CC1=CN(C2=C1C=CC=N2)CC3(C(C(C)C)N)CC=CC3 | UHZYJRSIIDPQRR-UHFFFAOYSA-N |
617B9A8A0526EA67_32C4E48ABB1E3BE6_6004_UN | C1(=CC2=C(C=C1)C(=O)OCC2)C3=C(OC)C=C(C=C3)F | ZQBQCFYHUSRUTP-UHFFFAOYSA-N |
61B05B22D2254010_AA378C8EA92B946D_6026_UN | O=[N](=O)C1=C(C=CC=N1)[S](=O)(=O)NCC2C(F)(F)C23CCC3 | IRVDGDVMOPJXKA-UHFFFAOYSA-N |
63F13CE51153347B_BAF6B97E8FCCA003_6022_UN | CN1C(=CC(=O)N=C1C2=CC=C(C=C2)CN3C=CC=CC3=O)N | UGJDWHADKWGCHJ-UHFFFAOYSA-N |
6444464E4D4C1874_B0D090AC302B70C1_6026_UN | CC4CC1=C(C(=CC(=C1)[S](=O)(=O)N3CC(C2=CC=CC(=C2)OC)C3)Cl)O4 | JMLGAZNUMWAEND-UHFFFAOYSA-N |
64DD2BC7748BDFF7_5CC9AEC670CD6B4B_6041_UN | CC1=NC(=C(C(=C1)C)[N](=O)=O)NC(CCCN(C)C)(C)C | FMKLUHZXUMZTRV-UHFFFAOYSA-N |
65484E9D74369AF4_9323E664E95E9CDB_6038_UN | CC(NC(=O)C1=C(C=CC(=C1)[S](=O)(=O)N2CCCCC2)N3CCCC3)C4=NC=CC=N4 | DRTFYIUKNVQURU-UHFFFAOYSA-N |
66645AA77BDA9AD7_64F7E43F30404D5D_6026_UN | CC1=CC(=CC(=C1)C2=CC=CC=C2)[S](=O)(=O)NCC3CCN(CC3)C4CC4 | MPJAVRYXJJKOJW-UHFFFAOYSA-N |
68ACD5378D99CC83_2987FB7F0E99740C_6026_DP | [S](=O)(=O)(C1=CC2=C(N=C1)C=CC=C2)NCC4=C(C3CNC3)OC=N4 | VPRRBIOZLAQQSN-UHFFFAOYSA-N |
69A19886C2E9794F_A33006507D76BAFA_6041_DP | C1(=NC=C(C=C1)[S](=O)(=O)N3CCC(CC2=CC=CC=C2)CC3)NC4CCCCC45CCCNC5 | ZYASSOICEHDDKO-UHFFFAOYSA-N |
6A1710A50FD3BF70_25267050FF734D66_6041_UN | O=[N](=O)C1=CC(=C(N=C1)NCC3(C2=CC=CC(=C2)OC)CC3)F | YFMPJSUAILMPDY-UHFFFAOYSA-N |
6D174E94F9831F29_62E625824E040D75_6034_UN | NC(C1=CC=CC=C1)C2=CC3=C(C=C2)N(C=N3)C4=C(N)NC(NC4=O)=O | DGVNBMQDONYJMY-UHFFFAOYSA-N |
6D263F4176B6175F_FE2D4516473AC2A4_6041_UN | OC(=O)C1=CC(=C(N=C1)F)NC2=CC=C(C=C2)OCCCN3CCCC3 | MOTFWYPYLADUPY-UHFFFAOYSA-N |
6EA2826A49CD487E_046566EDE49DA206_6026_UN | FC1(F)CC1[N]2C=CC(=N2)[S](=O)(=O)N3C(=C[N](=O)=O)SCCC3 | FBJQIJUUIWZLGN-UHFFFAOYSA-N |
6F5C84AB8F65D250_CADC5B37ACB90375_6041_UN | O=[N](=O)C2=C1N=CC=CC1=CC(=C2)NCC3=CC(=C(C=C3)F)COC4CCCC4 | OGJGPGNIUZNAGH-UHFFFAOYSA-N |
70C00BAF9063AF9E_1BD32CA705FE28F8_6034_UN | O=[N](=O)C1=CN(C2=C1C=C(C=N2)Br)CC3(C(C(C)C)N)CC=CC3 | XYVPNDRMQHQLNW-UHFFFAOYSA-N |
71E34DA6EB0F8AA8_07DBBDD502C3C60A_6038_UN | CC1=CC=C(C=C1)C(CNC(=O)C2=CC(=CC=C2)[S](=O)(=O)N3CCCCCC3)N4CCCC4 | SCPCGSPHWAYVDF-UHFFFAOYSA-N |
725C31398A7A5931_7FAB0DD8B286BF1D_6041_UN | O=[N](=O)C1=C(C2=C(N=C1)C=CC(=C2)F)NCC4(C3=C[N](C)N=C3)CCCO4 | FEEDNTVYNZWFMQ-UHFFFAOYSA-N |
726186A83578EC0A_FDE76BAF5A7C4274_6041_UN | C1(=NC=C(C=C1)[S](=O)(=O)N3CCC(CC2=CC=CC=C2)CC3)NCC4CCCCN4CC(C)C | YAFVCCSSWQUTHD-UHFFFAOYSA-N |
735B0AC704CE17D0_805F58A41DE1008F_6041_DP | C1(=NC=C(C=C1)[S](=O)(=O)N3CCC(CC2=CC=CC=C2)CC3)NCC(C)NC | DMNXVALCTZYTTL-UHFFFAOYSA-N |
774276CC08CDCE15_114D0A72A5A4143E_6004_UN | C1(=CC2=C(C=C1)C(=O)OCC2)C3=C(OC)C=CC(=C3)F | WNEOHYQNUQWAMZ-UHFFFAOYSA-N |
775867E4C1D4B30A_6C3EABBB4413E23F_6022_UN | CN1C(=C(N)C(=O)N=C1C2=CC=C(C=C2)CN3C=CC=CC3=O)N | FXYNOMJTTWFMPT-UHFFFAOYSA-N |
781FEE3BC086B4C7_75997F7408CE1B65_6026_UN | CC1=C(C=C(C=C1)[S](=O)(=O)N3CCC(CC2=CC(=C(C)C=C2)C)CC3)C | WLNYBZQEYNZBNX-UHFFFAOYSA-N |
78510DDEE34C50B8_93DF8A67EFADDBD2_6026_UN | ClC1=CC(=C(C=C1)OCC2CCCCO2)[S](=O)(=O)N4CCN(CC3=CSC(=N3)C)CC4 | LJJGSCBVKDSOLK-UHFFFAOYSA-N |
78B8FA79BEF40DFA_43E6028605B44948_7017_UN | CC2=C1C=CC=C(C1=CC=N2)[S](=O)(=O)N4CCC([N]3N=C(C)C=C3N)CC4 | VXOSTPMRSPKABI-UHFFFAOYSA-N |
79314EF9063FD3D8_47319664F7148ADA_6038_UN | COC1=C(C=C(C=C1)CN2CCCC2)NC(=O)C3=CC=C(C=C3)[S](=O)(=O)NC4CC4 | DVKXUHGJOQCKEW-UHFFFAOYSA-N |
7A26BBD1209A6BF1_9B7367A122045441_6031_UN | CC1=C(SC(=N1)SCC(=C)Cl)CC(=O)OCC2(CN(C)C)CC2 | ZRGFFILKAMNKSW-UHFFFAOYSA-N |
7CC0FEDF7A83216D_F4F7D2E1FA271460_6034_UN | N#[N]=NCCC1=CN(C2=C1C=CC=C2)CC3=NNC(=CC3=O)C | RUAPGIBJJDYMIX-UHFFFAOYSA-N |
7D8B774DBE2AA7DD_3CABBFF3CC5FA4E2_6041_DP | C1(=NC=C(C=C1)[S](=O)(=O)N3CCC(CC2=CC=CC=C2)CC3)NC5CCC(N4CCNCC4)CC5 | ITRWGCXTLYZBSX-UHFFFAOYSA-N |
7E824865C21C04AE_694A2C99C4C959D7_6038_UN | N(CC1=CC=C(C=C1)CN2CCCCC2)C(=O)C3=CC=C(C=C3)N4CCCN[S]4(=O)=O | WKIGASMBAFUUDE-UHFFFAOYSA-N |
80EE0A501DEFF269_D10BB8427ADEBF73_6041_UN | CN1CCC(CC1)[N]2N=CC3=C2N=CC(=C3)NCC4=C(C=CC=C4)[S](=O)(=O)N5CCCCC5 | ATJWBEQXMBSKTB-UHFFFAOYSA-N |
86133B69C4596771_6703C6F4BBC6E653_6038_UN | N(CC1C(CCCC1)N2CCCC2)C(=O)C3=CC=C(C=C3)N[S](=O)(=O)C4=CC=CS4 | RPIHPDLZZUDJHI-UHFFFAOYSA-N |
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