COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION
FULL DB
Total number of items: 1633432
Total number of pages: 1634 ( 1000 items on each page )
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STK530873
Synonyms: 2-amino-N-[2-(cyclohex-1-en-1-yl)ethyl]-1-(4-methylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Cc1ccc(cc1)n1c(N)c(c2c1nc1ccccc1n2)C(=O)NCCC1=CCCCC1
STK530876
Synonyms: (4E)-2-phenyl-4-(pyridin-4-ylmethylidene)-1,3-oxazol-5(4H)-one
Smiles: O=C1OC(=N/C/1=C/c1ccncc1)c1ccccc1
STK530877
Synonyms: (5E)-1-[2-(cyclohex-1-en-1-yl)ethyl]-5-[(1-methyl-1H-pyrrol-2-yl)methylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)/C(=C\c2cccn2C)/C(=O)N1CCC1=CCCCC1
STK530878
Synonyms: 2-amino-1-(4-methylphenyl)-N-phenyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Cc1ccc(cc1)n1c(N)c(c2c1nc1ccccc1n2)C(=O)Nc1ccccc1
STK530881
Synonyms: 4-[5,7-dibromo-2-(cyclohexylidenemethyl)-1-benzofuran-3-yl]morpholine
Smiles: Brc1cc(Br)c2c(c1)c(N1CCOCC1)c(o2)C=C1CCCCC1
STK530882
Synonyms: 10-(5-bromo-2-hydroxyphenyl)-11-hydroxy-7,7-dimethyl-6,7,8,10-tetrahydro-9H-indeno[1,2-b]quinolin-9-one
Smiles: Brc1ccc(c(c1)C1C2=C(N=C3C1=C(O)c1c3cccc1)CC(CC2=O)(C)C)O
STK530884
Synonyms: 3-methyl-7-(4-methylphenoxy)-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione
Smiles: Cc1ccc(cc1)Oc1cc2oc3cc(C)ccc3[nH]c2c2c1c(=O)c1c(c2=O)cccc1
STK530886
Synonyms: 7-ethyl-7-methyl-1-[(2-oxo-2-phenylethyl)sulfanyl]-4-phenyl-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CCC1(C)OCc2c(C1)c1c(s2)n2c(SCC(=O)c3ccccc3)nnc2n(c1=O)c1ccccc1
STK530887
Synonyms: 7-tert-butyl-4-hydrazinyl-2-(methylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Smiles: NNc1nc(SC)nc2c1c1CCC(Cc1s2)C(C)(C)C
STK530888
Synonyms: 7-[(furan-2-ylmethyl)amino]-3-methyl-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione
Smiles: Cc1ccc2c(c1)oc1c([nH]2)c2c(=O)c3ccccc3c(=O)c2c(c1)NCc1ccco1
STK530890
Synonyms: 1,1'-(2,3,5,6-tetramethylbenzene-1,4-diyl)bis(2-phenylethane-1,2-dione)
Smiles: O=C(C(=O)c1ccccc1)c1c(C)c(C)c(c(c1C)C)C(=O)C(=O)c1ccccc1
STK530893
Synonyms: N-[3-methyl-1-(methylamino)-1-oxobut-2-en-2-yl]benzamide
Smiles: CNC(=O)C(=C(C)C)NC(=O)c1ccccc1
STK530894
Synonyms: 4,6-dimethyl-2-oxo-N-{2-[(trifluoromethyl)sulfanyl]phenyl}-2H-pyran-5-carboxamide
Smiles: O=c1cc(C)c(c(o1)C)C(=O)Nc1ccccc1SC(F)(F)F
STK530895
Synonyms: ethyl(4E)-5-ethoxy-5-hydroxy-3-{[2-methyl-1-(4-methylphenyl)-5-(phenylcarbonyl)-1H-imidazol-4-yl]imino}pent-4-enoate
Smiles: CCOC(=O)C/C(=N\c1nc(n(c1C(=O)c1ccccc1)c1ccc(cc1)C)C)/C=C(/OCC)\O
STK530899
Synonyms: (5Z)-1-cyclohexyl-5-{4-methoxy-3-[(pyridin-2-ylsulfanyl)methyl]benzylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(cc1CSc1ccccn1)/C=C\1/C(=O)NC(=O)N(C1=O)C1CCCCC1
STK530900
Synonyms: 2-sulfanylpteridin-4-ol
Smiles: Sc1nc2nccnc2c(n1)O
STK530901
Synonyms: 5-{[2-(4-fluorophenyl)ethyl]amino}-6H-anthra[1,9-cd][1,2]oxazol-6-one
Smiles: Fc1ccc(cc1)CCNc1ccc2c3c1C(=O)c1ccccc1c3on2
STK530902
Synonyms: 2-[2,2-bis(3-fluorophenyl)ethenyl]-1-[2-(2-chlorophenoxy)ethyl]-1H-benzimidazole
Smiles: Fc1cccc(c1)/C(=C/c1nc2c(n1CCOc1ccccc1Cl)cccc2)/c1cccc(c1)F
STK530903
Synonyms: 9-(hexylsulfanyl)-8-(3-methylphenyl)-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: CCCCCCSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CCc1c3cccc1
STK530904
Synonyms: 8-benzyl-9-[(2-phenylethyl)sulfanyl]-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: O=c1c2c(sc3c2CCc2c3cccc2)nc(n1Cc1ccccc1)SCCc1ccccc1
STK530905
Synonyms: 5-phenyl-N-(2-phenylethyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine
Smiles: c1ccc(cc1)CCNc1ncnc2c1sc1c2c2CCCCc2c(n1)c1ccccc1
STK530906
Synonyms: 2-{2-[(3aS,6aS)-5-(2-methoxyphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazol-3-yl]-2-oxoethyl}-1H-isoindole-1,3(2H)-dione
Smiles: COc1ccccc1N1C(=O)[C@@H]2[C@H](C1=O)C(=NN2)C(=O)CN1C(=O)c2c(C1=O)cccc2
STK530907
Synonyms: N-{[4-(3-methylbutoxy)phenyl]carbonyl}leucine
Smiles: CC(CCOc1ccc(cc1)C(=O)NC(C(=O)O)CC(C)C)C
STK530908
Synonyms: 6-iodo-2-[(Z)-(1-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-3-(2-methylphenyl)quinazolin-4(3H)-one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C/1\C(=O)N(c2c1cccc2)C)c1ccccc1C
STK530910
Synonyms: N-(3-cyano-4-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide
Smiles: N#Cc1c(NC(=O)C)sc2c1C(C)CCC2
STK530912
Synonyms: 8-bromo-10a-[(E)-2-(4-fluorophenyl)ethenyl]-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Smiles: O=C1CCN2C(N1)(/C=C/c1ccc(cc1)F)C(C)(C)c1c2ccc(c1)Br
STK530913
Synonyms: 3-(2-methoxyphenyl)-6,6-dimethyl-2-(methylsulfanyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CSc1nc2sc3c(c2c(=O)n1c1ccccc1OC)CC(OC3)(C)C
STK530915
Synonyms: 3-{[(E)-(4-fluorophenyl)methylidene]amino}-2-pentyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CCCCCc1nc2sc3c(c2c(=O)n1/N=C/c1ccc(cc1)F)CCCC3
STK530919
Synonyms: 3-{[(1E,2Z)-2-benzylideneheptylidene]amino}-8-fluoro-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: CCCCC/C(=C/c1ccccc1)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(cc1)F
STK530921
Synonyms: 2-[(Z)-(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-6-iodo-3-(4-methylphenyl)quinazolin-4(3H)-one
Smiles: Cc1ccc(cc1)n1c(/C=C/2\C(=O)Nc3c2cc(Br)cc3)nc2c(c1=O)cc(cc2)I
STK530922
Synonyms: (5Z)-5-{4-methoxy-3-[(pyridin-2-ylsulfanyl)methyl]benzylidene}-1-(prop-2-en-1-yl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: C=CCN1C(=O)NC(=O)/C(=C/c2ccc(c(c2)CSc2ccccn2)OC)/C1=O
STK530924
Synonyms: 2-amino-N-phenyl-1-[3-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: O=C(c1c2nc3ccccc3nc2n(c1N)c1cccc(c1)C(F)(F)F)Nc1ccccc1
STK530925
Synonyms: 3-[(4-methoxybenzyl)sulfanyl]-9-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: COc1ccc(cc1)CSc1nnc2n1cnc1c2c2CCC(Cc2s1)C
STK530927
Synonyms: (5E)-1-(furan-2-ylmethyl)-5-[(2E)-3-(furan-2-yl)prop-2-en-1-ylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)/C(=C\C=C\c2ccco2)/C(=O)N1Cc1ccco1
STK530928
Synonyms: N-(4,7-dimethyl-2-oxo-2H-chromen-6-yl)propanamide
Smiles: Cc1cc2oc(=O)cc(c2cc1NC(=O)CC)C
STK530930
Synonyms: N-{[4-(3-methylbutoxy)phenyl]carbonyl}glycine
Smiles: CC(CCOc1ccc(cc1)C(=O)NCC(=O)O)C
STK530931
Synonyms: 2-amino-N-benzyl-1-(3-hydroxyphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Oc1cccc(c1)n1c(N)c(c2c1nc1ccccc1n2)C(=O)NCc1ccccc1
STK530933
Synonyms: (2E)-1-(6-bromo-2-hydroxy-4-phenylquinolin-3-yl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-en-1-one
Smiles: Brc1ccc2c(c1)c(c1ccccc1)c(c(n2)O)C(=O)/C=C/c1ccc2c(c1)OCCO2
STK530934
Synonyms: methyl3-({N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methylglycyl}amino)-5-methyl-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN(CCc1ccc(c(c1)OC)OC)C)cc(cc2)C
STK530936
Synonyms: 2-amino-N-benzyl-1-(2-methoxyethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COCCn1c(N)c(c2c1nc1ccccc1n2)C(=O)NCc1ccccc1
STK530938
Synonyms: 2-[(Z)-(5-bromo-1-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-6-iodo-3-(2-methylphenyl)quinazolin-4(3H)-one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C\1/c2cc(Br)ccc2N(C1=O)C)c1ccccc1C
STK530939
Synonyms: (2E)-1-(6-bromo-2-hydroxy-4-phenylquinolin-3-yl)-3-(3,4-dimethoxyphenyl)prop-2-en-1-one
Smiles: COc1cc(/C=C/C(=O)c2c(O)nc3c(c2c2ccccc2)cc(cc3)Br)ccc1OC
STK530940
Synonyms: (2Z,4E)-3-methyl-5-(thiophen-2-yl)penta-2,4-dienoicacid
Smiles: OC(=O)/C=C(\C=C\c1cccs1)/C
STK530941
Synonyms: 4,6-diphenyl-2-[(2E)-2-(pyridin-2-ylmethylidene)hydrazinyl]pyrimidine
Smiles: c1ccc(nc1)/C=N/Nc1nc(cc(n1)c1ccccc1)c1ccccc1
STK530944
Synonyms: benzylN-[(2E)-3-(4-bromophenyl)-2-{[(2-methoxyphenyl)carbonyl]amino}prop-2-enoyl]glycinate
Smiles: COc1ccccc1C(=O)N/C(=C/c1ccc(cc1)Br)/C(=O)NCC(=O)OCc1ccccc1
STK530946
Synonyms: 6,6-dimethyl-3-(2-methylpropyl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CC(Cn1c(SCC(=O)c2ccccc2)nc2c(c1=O)c1CC(C)(C)OCc1s2)C
STK530947
Synonyms: 2-amino-N-[2-(cyclohex-1-en-1-yl)ethyl]-1-(3-methylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Cc1cccc(c1)n1c(N)c(c2c1nc1ccccc1n2)C(=O)NCCC1=CCCCC1
STK530948
Synonyms: 1-(3,4-dichlorophenyl)-2-{3-[2-(diethylamino)ethyl]-2-imino-2,3-dihydro-1H-benzimidazol-1-yl}ethanone
Smiles: CCN(CCn1c(=N)n(c2c1cccc2)CC(=O)c1ccc(c(c1)Cl)Cl)CC
STK530951
Synonyms: 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-(3-methoxyphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: COc1cccc(c1)n1c(SCC(=O)c2ccc(cc2)Br)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
STK530952
Synonyms: 2,8,12,18-tetrabutyl-3,7,13,17-tetramethylporphyrin
Smiles: CCCCC1=C(C)/C/2=C/c3[nH]c(c(c3C)CCCC)/C=C/3\N=C(/C=c/4\[nH]/c(=C\C1=N2)/c(CCCC)c4C)C(=C3CCCC)C
STK530954
Synonyms: 2-(hexylsulfanyl)-3-(4-methoxyphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CCCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)OC)CCCCC3
STK530955
Synonyms: 2-amino-1-benzyl-N-(3-methylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Cc1cccc(c1)NC(=O)c1c2nc3ccccc3nc2n(c1N)Cc1ccccc1
STK530957
Synonyms: 6-ethyl-4-hydrazinyl-6-methyl-2-(methylsulfanyl)-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Smiles: CSC1N=C(NN)c2c(N1)sc1c2CC(OC1)(C)CC
STK530958
Synonyms: 7-(morpholin-4-yl)-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione
Smiles: O=c1c2c3[nH]c4ccccc4oc3cc(c2c(=O)c2c1cccc2)N1CCOCC1
STK530960
Synonyms: 2-({2-[2-(8-fluoro-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)-2-oxoethyl]-1,2,3,4-tetrahydroisoquinolin-1-yl}methyl)-1H-isoindole-1,3(2H)-dione
Smiles: Fc1ccc2c(c1)c1CN(CCc1[nH]2)C(=O)CN1CCc2c(C1CN1C(=O)c3c(C1=O)cccc3)cccc2
STK530961
Synonyms: 10-ethyl-3-[(4-methoxybenzyl)sulfanyl]-10-methyl-5-(methylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CCC1(C)OCc2c(C1)c1c(s2)nc(n2c1nnc2SCc1ccc(cc1)OC)SC
STK530962
Synonyms: (3Z)-5-(2-methylpropyl)-3-[(5-phenylfuran-2-yl)methylidene]furan-2(3H)-one
Smiles: CC(CC1=C/C(=C/c2ccc(o2)c2ccccc2)/C(=O)O1)C
STK530963
Synonyms: 1-chloro-3-(8-methyl-1,2,3a,4,5,6-hexahydro-3H-pyrazino[3,2,1-jk]carbazol-3-yl)propan-2-ol
Smiles: ClCC(CN1CCn2c3C1CCCc3c1c2ccc(c1)C)O
STK530965
Synonyms: (2Z)-2-cyano-3-[(3-fluorobenzyl)amino]-N-(2-phenylethyl)but-2-enamide
Smiles: N#C/C(=C(/NCc1cccc(c1)F)\C)/C(=O)NCCc1ccccc1
STK530966
Synonyms: 1-[4-hydroxy-3-(hydroxymethyl)phenyl]ethanone
Smiles: OCc1cc(ccc1O)C(=O)C
STK530968
Synonyms: 2-(1-phenylethyl)-1H-naphtho[2,3-g]indazole-3,6,11(2H)-trione
Smiles: CC(n1[nH]c2c(c1=O)ccc1c2c(=O)c2ccccc2c1=O)c1ccccc1
STK530969
Synonyms: 4-methyl-6-[(2E)-2-(4-nitrobenzylidene)hydrazinyl]-2-phenylpyrimidine
Smiles: Cc1cc(N/N=C/c2ccc(cc2)[N+](=O)[O-])nc(n1)c1ccccc1
STK530970
Synonyms: 2-amino-N-(1,3-benzodioxol-5-ylmethyl)-1-[2-(2-fluorophenyl)ethyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: O=C(c1c(N)n(c2c1nc1ccccc1n2)CCc1ccccc1F)NCc1ccc2c(c1)OCO2
STK530971
Synonyms: 5-[(2,2-dimethoxyethyl)amino]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Smiles: COC(CNc1ccc2c3c1C(=O)c1ccccc1c3on2)OC
STK530972
Synonyms: 7-benzyl-3-cyclohexyl-2-[(naphthalen-1-ylmethyl)sulfanyl]-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: O=c1n(C2CCCCC2)c(SCc2cccc3c2cccc3)nc2c1c1CCN(Cc1s2)Cc1ccccc1
STK530973
Synonyms: 2-[(E)-2-(dimethylamino)ethenyl]-1,8-diphenyl-1,5,6,7-tetrahydrocyclopenta[b]pyrrolo[2,3-e]pyridine-3-carbonitrile
Smiles: N#Cc1c2nc3CCCc3c(c2n(c1/C=C/N(C)C)c1ccccc1)c1ccccc1
STK530974
Synonyms: N'-dodecanoyl-1-ethyl-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carbohydrazide
Smiles: CCCCCCCCCCCC(=O)NNC(=O)c1c(O)c2ccccc2n(c1=O)CC
STK530975
Synonyms: 2-amino-1-benzyl-N-phenyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: O=C(c1c2nc3ccccc3nc2n(c1N)Cc1ccccc1)Nc1ccccc1
STK530977
Synonyms: 8-(furan-2-yl)-3,3-dimethyl-6-[(2-phenylethyl)amino]-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Smiles: N#Cc1c(NCCc2ccccc2)nc(c2c1CC(C)(C)OC2)c1ccco1
STK530978
Synonyms: 2-amino-1-(4-methoxyphenyl)-N-(naphthalen-1-yl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: COc1ccc(cc1)n1c(N)c(c2c1nc1ccccc1n2)C(=O)Nc1cccc2c1cccc2
STK530980
Synonyms: 4,8-dimethyl-1-sulfanyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CC1CCc2c(C1)sc1c2c(=O)n(c2n1c(S)nn2)C
STK530981
Synonyms: 3-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}-8-fluoro-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: COc1ccc(cc1OC)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(cc1)F
STK530982
Synonyms: 2-[4-(4-chlorophenyl)piperazin-1-yl]-1-(5-methoxy-1H-indol-3-yl)ethanone
Smiles: COc1ccc2c(c1)c(c[nH]2)C(=O)CN1CCN(CC1)c1ccc(cc1)Cl
STK530983
Synonyms: (2E)-2-{[(butylcarbamoyl)oxy]imino}-N-(4-methylphenyl)ethanamide
Smiles: CCCCNC(=O)O/N=C/C(=O)Nc1ccc(cc1)C
STK530985
Synonyms: 1-(5H-pyrimido[5,4-b]indol-4-yl)piperidine-4-carboxamide
Smiles: NC(=O)C1CCN(CC1)c1ncnc2c1[nH]c1c2cccc1
STK530986
Synonyms: 2-amino-N-(1,3-benzodioxol-5-ylmethyl)-1-(furan-2-ylmethyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: O=C(c1c(N)n(c2c1nc1ccccc1n2)Cc1ccco1)NCc1ccc2c(c1)OCO2
STK530987
Synonyms: 2-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-7-benzyl-3-cyclohexyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: O=c1c2c(sc3c2CCN(C3)Cc2ccccc2)nc(n1C1CCCCC1)SCc1ccc2c(c1)OCO2
STK530989
Synonyms: 1-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-4-phenyl-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: O=c1c2c3CCCc3sc2n2c(n1c1ccccc1)nnc2SCc1ccc2c(c1)OCO2
STK530991
Synonyms: 8-tert-butyl-4-methyl-1-[(2-methylprop-2-en-1-yl)sulfanyl]-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CC(=C)CSc1nnc2n1c1sc3c(c1c(=O)n2C)CCC(C3)C(C)(C)C
STK530992
Synonyms: (2E,4E)-3-methyl-5-(5-methylfuran-2-yl)penta-2,4-dienoicacid
Smiles: OC(=O)/C=C(/C=C/c1ccc(o1)C)\C
STK530995
Synonyms: (9aS)-9a-{(E)-2-[4-(diethylamino)phenyl]ethenyl}-9,9-dimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one
Smiles: CCN(c1ccc(cc1)/C=C/[C@]12NC(=O)CN1c1c(C2(C)C)cccc1)CC
STK530997
Synonyms: 4-(3,3-dimethylpiperidin-1-yl)-8-fluoro-5H-pyrimido[5,4-b]indole
Smiles: Fc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCCC(C1)(C)C
STK530998
Synonyms: N-tert-butyl-3-[2-(4-methoxyphenyl)-1H-imidazo[1,2-a]benzimidazol-1-yl]propan-1-amine
Smiles: COc1ccc(cc1)c1cn2c(n1CCCNC(C)(C)C)nc1c2cccc1
STK531000
Synonyms: 5-(6,8-dioxo-6H,7H,8H-pyrano[3,2-c:5,6-c']dichromen-7-yl)-2-methoxybenzylacetate
Smiles: COc1ccc(cc1COC(=O)C)C1c2c(=O)oc3c(c2Oc2c1c(=O)oc1c2cccc1)cccc3
STK531001
Synonyms: 2,6-di-tert-butyl-4-(7-methyl-2,3-diphenylimidazo[1,2-b][1,2,4]triazin-6-yl)phenol
Smiles: Cc1c(nc2n1nc(c1ccccc1)c(n2)c1ccccc1)c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C
STK531003
Synonyms: (9aS)-9,9-dimethyl-9a-[(E)-2-(4-methylphenyl)ethenyl]-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one
Smiles: Cc1ccc(cc1)/C=C/[C@]12NC(=O)CN1c1c(C2(C)C)cccc1
STK531004
Synonyms: methyl2,4-dimethyl-5-[(2Z)-2-(1-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)acetyl]-1H-pyrrole-3-carboxylate
Smiles: COC(=O)c1c(C)[nH]c(c1C)C(=O)/C=C\1/c2ccccc2N(C1=O)C
STK531005
Synonyms: 11-methyl-3,7-bis(methylsulfanyl)-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:4',3'-c]pyrimidine
Smiles: CSc1nnc2n1c1sc3c(c1c1n2c(SC)nn1)CCC(C3)C
STK531007
Synonyms: 8-fluoro-3-[2-(4-fluorophenyl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Fc1ccc(cc1)CCn1cnc2c(c1=O)[nH]c1c2cc(cc1)F
STK531012
Synonyms: 1,3-bis[(3-chlorophenyl)(phenyl)methyl]urea
Smiles: Clc1cccc(c1)C(c1ccccc1)NC(=O)NC(c1cccc(c1)Cl)c1ccccc1
STK531015
Synonyms: 1-(5-methoxy-1,2-dimethyl-1H-indol-3-yl)-2-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}ethanone
Smiles: COc1ccc2c(c1)c(C(=O)CN1CCN(CC1)C/C=C/c1ccccc1)c(n2C)C
STK531019
Synonyms: 1-(5-methoxy-1H-indol-3-yl)-2-(4-phenylpiperazin-1-yl)ethanone
Smiles: COc1ccc2c(c1)c(c[nH]2)C(=O)CN1CCN(CC1)c1ccccc1
STK531020
Synonyms: 1,3-dimethyl-8-[(3-methylbenzyl)sulfanyl]-7-(2-methylprop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(=C)Cn1c(SCc2cccc(c2)C)nc2c1c(=O)n(c(=O)n2C)C
STK531023
Synonyms: 3-[(4-methoxybenzyl)sulfanyl]-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: COc1ccc(cc1)CSc1nnc2n1cnc1c2c2CCCCc2s1
STK531024
Synonyms: ethyl3,3,3-trifluoro-2-({[3-(trifluoromethyl)phenyl]carbamoyl}oxy)propanoate
Smiles: CCOC(=O)C(C(F)(F)F)OC(=O)Nc1cccc(c1)C(F)(F)F
STK531029
Synonyms: 2-(4-methylphenyl)-1-[3-(piperidin-1-yl)propyl]-1H-imidazo[1,2-a]benzimidazole
Smiles: Cc1ccc(cc1)c1cn2c(n1CCCN1CCCCC1)nc1c2cccc1
STK531031
Synonyms: 2-amino-N-(1,3-benzodioxol-5-ylmethyl)-1-pentyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCCCCn1c(N)c(c2c1nc1ccccc1n2)C(=O)NCc1ccc2c(c1)OCO2
STK531032
Synonyms: 2-amino-N-butyl-1-(4-chlorophenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: CCCCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)c1ccc(cc1)Cl
STK531033
Synonyms: (5Z)-1-(4-ethylphenyl)-5-({[2-(pyridin-3-yl)piperidin-1-yl]amino}methylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCc1ccc(cc1)N1C(=O)NC(=O)/C(=C/NN2CCCCC2c2cccnc2)/C1=O
STK531034
Synonyms: 2-{(2E)-2-[(5-nitrofuran-2-yl)methylidene]hydrazinyl}-3-phenylquinazolin-4(3H)-one
Smiles: O=c1n(c2ccccc2)c(N/N=C/c2ccc(o2)[N+](=O)[O-])nc2c1cccc2
STK531035
Synonyms: 10a-[(E)-2-(4-methoxyphenyl)ethenyl]-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Smiles: COc1ccc(cc1)/C=C/C12NC(=O)CCN1c1c(C2(C)C)cccc1
STK531039
Synonyms: 3-(2-methoxyphenyl)-6,6-dimethyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: COc1ccccc1n1c(SCC(=O)c2ccccc2)nc2c(c1=O)c1CC(C)(C)OCc1s2
STK531040
Synonyms: 9-{1-[4-(propan-2-yl)phenyl]propan-2-yl}-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Smiles: CC(c1ccc(cc1)CC(C1C2=C(CCCC2=O)OC2=C1C(=O)CCC2)C)C
STK531041
Synonyms: N'-(3,4-dihydro-1H-isochromen-1-ylmethyl)-N,N-dimethylpropane-1,3-diamine
Smiles: CN(CCCNCC1OCCc2c1cccc2)C
STK531044
Synonyms: ethyl{[6-tert-butyl-3-cyano-4-(thiophen-2-yl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nc2CCC(Cc2c(c1C#N)c1cccs1)C(C)(C)C
STK531045
Synonyms: 4-(3,4-dihydroisoquinolin-2(1H)-yl)-8-fluoro-5H-pyrimido[5,4-b]indole
Smiles: Fc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCc2c(C1)cccc2
STK531046
Synonyms: 3-(4-methoxyphenyl)-2-(pentylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)OC)CCCCC3
STK531049
Synonyms: 1-{[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl}-8-methyl-4-phenyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: COc1ccc(cc1)C(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCC(C3)C
STK531051
Synonyms: (2E)-3-(4-methoxybenzyl)-2-{(2Z)-[1-(4-propoxyphenyl)ethylidene]hydrazinylidene}-1,3-thiazolidin-4-one
Smiles: CCCOc1ccc(cc1)/C(=N\N=C/1\SCC(=O)N1Cc1ccc(cc1)OC)/C
STK531052
Synonyms: 4-{[(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)amino]methyl}phenol
Smiles: Oc1ccc(cc1)CNCC1COc2c(O1)cccc2
STK531053
Synonyms: 5-phenyl-N-(tetrahydrofuran-2-ylmethyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine
Smiles: C1COC(C1)CNc1ncnc2c1sc1c2c2CCCCc2c(n1)c1ccccc1
STK531054
Synonyms: 2-[(2E)-2-(4-methoxybenzylidene)-1-methylhydrazinyl]-4-[4-(phenylsulfanyl)phenyl]-1,3-thiazole
Smiles: COc1ccc(cc1)/C=N/N(c1scc(n1)c1ccc(cc1)Sc1ccccc1)C
STK531056
Synonyms: 3,6,9,10-tetraphenyl-3,4,6,7,9,10-hexahydroacridine-1,8(2H,5H)-dione
Smiles: O=C1CC(CC2=C1C(c1ccccc1)C1=C(N2c2ccccc2)CC(CC1=O)c1ccccc1)c1ccccc1
STK531057
Synonyms: 8-benzyl-1-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-4-phenyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: Clc1ccc(cc1)C(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCN(C3)Cc1ccccc1
STK531058
Synonyms: 1-nitro-9,10-dioxo-N-(2-phenylethyl)-9,10-dihydroanthracene-2-carboxamide
Smiles: [O-][N+](=O)c1c(ccc2c1C(=O)c1ccccc1C2=O)C(=O)NCCc1ccccc1
STK531059
Synonyms: 2-[(2E)-2-benzylidene-1-methylhydrazinyl]-4-[4-(phenylsulfanyl)phenyl]-1,3-thiazole
Smiles: CN(c1scc(n1)c1ccc(cc1)Sc1ccccc1)/N=C/c1ccccc1
STK531062
Synonyms: 2-amino-N-(4-methylphenyl)-1-[3-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Cc1ccc(cc1)NC(=O)c1c2nc3ccccc3nc2n(c1N)c1cccc(c1)C(F)(F)F
STK531063
Synonyms: 7-[(4-methoxybenzyl)amino]-3-methyl-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione
Smiles: COc1ccc(cc1)CNc1cc2oc3cc(C)ccc3[nH]c2c2c1c(=O)c1c(c2=O)cccc1
STK531064
Synonyms: 2-[(4-methoxybenzyl)sulfanyl]-3-(4-methylphenyl)-7-propyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CCCN1CCc2c(C1)sc1c2c(=O)n(c(n1)SCc1ccc(cc1)OC)c1ccc(cc1)C
STK531067
Synonyms: (3Z)-3-[(1-methyl-1H-pyrrol-3-yl)methylidene]-4-(propan-2-ylidene)dihydrofuran-2,5-dione
Smiles: Cn1ccc(c1)/C=C/1\C(=O)OC(=O)C1=C(C)C
STK531070
Synonyms: 1-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-4-(4-methoxyphenyl)-8-methyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: COc1ccc(cc1)n1c2nnc(n2c2c(c1=O)c1CCC(Cc1s2)C)SCc1ccc2c(c1)OCO2
STK531072
Synonyms: N,N'-(butane-1,4-diylbis{imino[(1Z)-1-(4-hydroxyphenyl)-3-oxoprop-1-ene-3,2-diyl]})dibenzamide
Smiles: Oc1ccc(cc1)/C=C(/C(=O)NCCCCNC(=O)/C(=C/c1ccc(cc1)O)/NC(=O)c1ccccc1)\NC(=O)c1ccccc1
STK531077
Synonyms: 1-[(2,4-dimethylbenzyl)sulfanyl]-4-(2-methoxyphenyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Smiles: COc1ccccc1n1c2nnc(n2c2c(c1=O)C1(CCCCC1)Cc1c2cccc1)SCc1ccc(cc1C)C
STK531083
Synonyms: 2-amino-N-(3-methylphenyl)-1-[3-(trifluoromethyl)phenyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Cc1cccc(c1)NC(=O)c1c2nc3ccccc3nc2n(c1N)c1cccc(c1)C(F)(F)F
STK531084
Synonyms: N-{4-[(5-ethyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl}-8-methoxy-2-oxo-2H-chromene-3-carboxamide
Smiles: CCc1nnc(s1)NS(=O)(=O)c1ccc(cc1)NC(=O)c1cc2cccc(c2oc1=O)OC
STK531085
Synonyms: N-{3-methyl-2-[(phenylcarbonyl)amino]but-2-enoyl}valine
Smiles: O=C(c1ccccc1)NC(=C(C)C)C(=O)NC(C(=O)O)C(C)C
STK531088
Synonyms: 6-[(Z)-{2-[4-(ethoxycarbonyl)phenyl]hydrazinylidene}methyl]-2,3-dimethoxybenzoicacid
Smiles: CCOC(=O)c1ccc(cc1)N/N=C\c1ccc(c(c1C(=O)O)OC)OC
STK531091
Synonyms: 1-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6-methyl-4-phenyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: Clc1ccc(cc1)C(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)C(C)CCC3
STK531092
Synonyms: 8-methyl-3-[2-(pyrrolidin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Cc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)CCN1CCCC1
STK531093
Synonyms: N-butyl-N-methyl-5-phenyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine
Smiles: CCCCN(c1ncnc2c1sc1c2c2CCCCc2c(n1)c1ccccc1)C
STK531096
Synonyms: 1-{[4-(3-methylbutoxy)phenyl]carbonyl}proline
Smiles: CC(CCOc1ccc(cc1)C(=O)N1CCCC1C(=O)O)C
STK531097
Synonyms: 5-methyl-2-(propan-2-yl)cyclohexylN-tert-butyl-P-phenylphosphonamidate
Smiles: CC1CCC(C(C1)OP(=O)(c1ccccc1)NC(C)(C)C)C(C)C
STK531098
Synonyms: 4-(4-methoxyphenyl)-1-[(2-methylprop-2-en-1-yl)sulfanyl]-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: COc1ccc(cc1)n1c2nnc(n2c2c(c1=O)c1CCCc1s2)SCC(=C)C
STK531100
Synonyms: 10a-[(E)-2-(4-chlorophenyl)ethenyl]-8,10,10-trimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Smiles: O=C1CCN2C(N1)(/C=C/c1ccc(cc1)Cl)C(C)(C)c1c2ccc(c1)C
STK531103
Synonyms: 2,6-di-tert-butylnaphthalene-1,5-diyldiacetate
Smiles: CC(=O)Oc1c2ccc(c(c2ccc1C(C)(C)C)OC(=O)C)C(C)(C)C
STK531104
Synonyms: 2-amino-1-(3-methylphenyl)-N-phenyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Smiles: Cc1cccc(c1)n1c(N)c(c2c1nc1ccccc1n2)C(=O)Nc1ccccc1
STK531105
Synonyms: 2-(4-bromophenyl)-1-[3-(morpholin-4-yl)propyl]-1H-imidazo[1,2-a]benzimidazole
Smiles: Brc1ccc(cc1)c1cn2c(n1CCCN1CCOCC1)nc1c2cccc1
STK531106
Synonyms: 5,5'-(piperazine-1,4-diyldicarbonyl)bis(4,6-dimethyl-2H-pyran-2-one)
Smiles: O=c1cc(C)c(c(o1)C)C(=O)N1CCN(CC1)C(=O)c1c(C)cc(=O)oc1C
STK531107
Synonyms: 2-[(Z)-(5-bromo-1-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-6-iodo-3-phenylquinazolin-4(3H)-one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C\1/c2cc(Br)ccc2N(C1=O)C)c1ccccc1
STK531108
Synonyms: 5-(3-methylphenoxy)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Smiles: Cc1cccc(c1)Oc1ccc2c3c1C(=O)c1ccccc1c3on2
STK531110
Synonyms: 2-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-6-ethyl-3-(4-methoxyphenyl)-6-methyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCC1(C)OCc2c(C1)c1c(s2)nc(n(c1=O)c1ccc(cc1)OC)SCc1ccc2c(c1)OCO2
STK531111
Synonyms: 3-benzyl-5-cyclohexyl-5-methyl-2-(methylsulfanyl)-5,6-dihydrobenzo[h]quinazolin-4(3H)-one
Smiles: CSc1nc2c3ccccc3CC(c2c(=O)n1Cc1ccccc1)(C)C1CCCCC1
STK531112
Synonyms: ethyl5-bromo-3-[(N,N-dimethyl-beta-alanyl)amino]-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN(C)C)cc(cc2)Br
STK531113
Synonyms: 4,4,8,8-tetrachloro-1,3,6-triphenyl-2-oxatricyclo[5.1.0.0~3,5~]octane
Smiles: ClC1(Cl)C2C1(OC1(C(C2c2ccccc2)C1(Cl)Cl)c1ccccc1)c1ccccc1
STK531114
Synonyms: 1-(heptylsulfanyl)-8-methyl-4-phenyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CCCCCCCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCC(C3)C
STK531115
Synonyms: 6-iodo-3-(3-methylphenyl)-2-{(Z)-[2-oxo-1-(propan-2-yl)-1,2-dihydro-3H-indol-3-ylidene]methyl}quinazolin-4(3H)-one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C\1/c2ccccc2N(C1=O)C(C)C)c1cccc(c1)C
STK531116
Synonyms: 8-benzyl-1-[(2-methylprop-2-en-1-yl)sulfanyl]-4-phenyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CC(=C)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCN(C3)Cc1ccccc1
STK531118
Synonyms: ethyl(2E)-(3-oxo-2-benzofuran-1(3H)-ylidene)(phenyl)ethanoate
Smiles: CCOC(=O)/C(=C\1/OC(=O)c2c1cccc2)/c1ccccc1
STK531119
Synonyms: 8-benzyl-1-(heptylsulfanyl)-4-phenyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CCCCCCCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCN(C3)Cc1ccccc1
STK531121
Synonyms: N-[(1Z)-1-(4-bromophenyl)-3-{[2-(1H-indol-3-yl)ethyl]amino}-3-oxoprop-1-en-2-yl]-3,4-dimethoxybenzamide
Smiles: COc1cc(ccc1OC)C(=O)N/C(=C\c1ccc(cc1)Br)/C(=O)NCCc1c[nH]c2c1cccc2
STK531122
Synonyms: 7,7-dimethyl-1-[(naphthalen-1-ylmethyl)sulfanyl]-4-phenyl-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: O=c1c2c3CC(C)(C)OCc3sc2n2c(n1c1ccccc1)nnc2SCc1cccc2c1cccc2
STK531123
Synonyms: 2-(hexylsulfanyl)-3-phenyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: CCCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1)CCCC3
STK531125
Synonyms: (9aS)-7-bromo-9a-{(E)-2-[4-(dimethylamino)phenyl]ethenyl}-9,9-dimethyl-9,9a-dihydro-1H-imidazo[1,2-a]indol-2(3H)-one
Smiles: O=C1CN2[C@@](N1)(/C=C/c1ccc(cc1)N(C)C)C(c1c2ccc(c1)Br)(C)C
STK531126
Synonyms: N-[(diphenylmethyl)carbamoyl]-Nalpha-(phenylcarbonyl)phenylalaninamide
Smiles: O=C(NC(=O)C(NC(=O)c1ccccc1)Cc1ccccc1)NC(c1ccccc1)c1ccccc1
STK531127
Synonyms: 2-[(5-cyclohexyl-5-methyl-4-oxo-3-phenyl-3,4,5,6-tetrahydrobenzo[h]quinazolin-2-yl)sulfanyl]acetamide
Smiles: NC(=O)CSc1nc2c3ccccc3CC(c2c(=O)n1c1ccccc1)(C)C1CCCCC1
STK531129
Synonyms: 2-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-7-benzyl-3-(4-methoxyphenyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: COc1ccc(cc1)n1c(SCc2ccc3c(c2)OCO3)nc2c(c1=O)c1CCN(Cc1s2)Cc1ccccc1
STK531131
Synonyms: 2-(2-chlorophenyl)-3-(4-nitrophenyl)quinazolin-4(3H)-one
Smiles: Clc1ccccc1c1nc2ccccc2c(=O)n1c1ccc(cc1)[N+](=O)[O-]
STK531132
Synonyms: 3,3'-[butane-1,4-diylbis(oxybenzene-4,1-diyl)]bis(1-methylpyrrolidine-2,5-dione)
Smiles: CN1C(=O)CC(C1=O)c1ccc(cc1)OCCCCOc1ccc(cc1)C1CC(=O)N(C1=O)C
STK531133
Synonyms: 1-(butylsulfanyl)-4-phenyl-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclopentan]-5(7H)-one
Smiles: CCCCSc1nnc2n1c1c3ccccc3CC3(c1c(=O)n2c1ccccc1)CCCC3
STK531134
Synonyms: (5E)-1-(2-chlorophenyl)-5-[(1-methyl-1H-pyrrol-2-yl)methylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C/c1cccn1C)c1ccccc1Cl
STK531137
Synonyms: N-(1-benzofuran-2-ylmethyl)-N,N',N'-triethylpentane-1,5-diamine
Smiles: CCN(CCCCCN(Cc1cc2c(o1)cccc2)CC)CC
STK531138
Synonyms: 2,4,5,6-tetrachloropyridine-3-carboxylicacid
Smiles: OC(=O)c1c(Cl)nc(c(c1Cl)Cl)Cl
STK531139
Synonyms: 5-ethyl-1-phenyl-4,5,6,7-tetrahydro-1H-[1,2,3]triazolo[4,5-c]pyridine
Smiles: CCN1CCc2c(C1)nnn2c1ccccc1
STK531140
Synonyms: 5-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-6H-anthra[1,9-cd][1,2]oxazol-6-one
Smiles: O=C1c2ccccc2c2c3c1c(NCCC1=CCCCC1)ccc3no2
STK531142
Synonyms: 10a-[(E)-2-(2,4-dichlorophenyl)ethenyl]-10,10-dimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Smiles: Clc1ccc(c(c1)Cl)/C=C/C12NC(=O)CCN1c1c(C2(C)C)cccc1
STK531143
Synonyms: (4aS,9bR)-2,8-dimethyl-5-[(4-nitrophenyl)sulfonyl]-2,3,4,4a,5,9b-hexahydro-1H-pyrido[4,3-b]indole
Smiles: CN1CC[C@H]2[C@@H](C1)c1cc(C)ccc1N2S(=O)(=O)c1ccc(cc1)[N+](=O)[O-]
STK531144
Synonyms: N-(3-hydroxyphenyl)-3-[(5E)-5-(3-{3-[(3-hydroxyphenyl)amino]-3-oxopropyl}-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanamide
Smiles: O=C(Nc1cccc(c1)O)CCN1C(=S)S/C(=C\2/SC(=S)N(C2=O)CCC(=O)Nc2cccc(c2)O)/C1=O
STK531145
Synonyms: 3-(furan-2-ylmethyl)-2-(hexylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CCCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCCC3
STK531146
Synonyms: 5-(morpholin-4-yl)-8-(2-phenylhydrazinyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: O1CCN(CC1)c1nc2sc3c(c2c2c1CCCC2)ncnc3NNc1ccccc1
STK531150
Synonyms: (6Z)-6-{3-chloro-5-ethoxy-4-[(4-fluorobenzyl)oxy]benzylidene}-2-ethyl-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCOc1cc(cc(c1OCc1ccc(cc1)F)Cl)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)CC
STK531152
Synonyms: 5-methyl-2-(propan-2-yl)cyclohexyl[4-(dimethylamino)phenyl][(4-fluorophenyl)(hydroxy)methyl]phosphinate
Smiles: CC1CCC(C(C1)OP(=O)(C(c1ccc(cc1)F)O)c1ccc(cc1)N(C)C)C(C)C
STK531154
Synonyms: 2-(5-amino-1,3,4-thiadiazol-2-yl)-N'-{(E)-[4-(naphthalen-1-ylmethoxy)phenyl]methylidene}acetohydrazide
Smiles: O=C(Cc1nnc(s1)N)N/N=C/c1ccc(cc1)OCc1cccc2c1cccc2
STK531155
Synonyms: 2,2'-(butane-1,4-diyldisulfanediyl)bis[3-(4-methylphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one]
Smiles: Cc1ccc(cc1)n1c(SCCCCSc2nc3c4ccccc4CC4(c3c(=O)n2c2ccc(cc2)C)CCCCC4)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
STK531156
Synonyms: (2Z)-N-{2-[(2E)-2-(2,4-dihydroxybenzylidene)hydrazinyl]-2-oxoethyl}-3-(2-methoxyphenyl)prop-2-enamide(non-preferredname)
Smiles: COc1ccccc1/C=C\C(=O)NCC(=O)N/N=C/c1ccc(cc1O)O
STK531157
Synonyms: copper(2+)bis[N-(2-methylheptan-2-yl)quinoline-2-carbimidothioate]
Smiles: CCCCCC(/N=C(/c1ccc2c(n1)cccc2)\S[Cu]S/C(=N\C(CCCCC)(C)C)/c1ccc2c(n1)cccc2)(C)C
STK531158
Synonyms: N-[5-(2-{(2Z)-2-[3-(naphthalen-1-ylmethoxy)benzylidene]hydrazinyl}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]benzamide
Smiles: O=C(Cc1nnc(s1)NC(=O)c1ccccc1)N/N=C\c1cccc(c1)OCc1cccc2c1cccc2
STK531161
Synonyms: 3-fluoro-N-{2-oxo-2-[(2E)-2-(1-phenylpropan-2-ylidene)hydrazinyl]ethyl}benzamide(non-preferredname)
Smiles: O=C(CNC(=O)c1cccc(c1)F)N/N=C(/Cc1ccccc1)\C
STK531162
Synonyms: N-[5-(4-chlorobenzyl)-1,3-thiazol-2-yl]-4-[(5Z)-5-(4-ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanamide
Smiles: CCc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCCC(=O)Nc1ncc(s1)Cc1ccc(cc1)Cl
STK531163
Synonyms: N,N-diethylphenazine-1-carboxamide
Smiles: CCN(C(=O)c1cccc2c1nc1ccccc1n2)CC
STK531164
Synonyms: 11-benzyl-3,7-bis[(3,4-dichlorobenzyl)sulfanyl]-10,11,12,13-tetrahydropyrido[4',3':4,5]thieno[3,2-e]bis[1,2,4]triazolo[4,3-a:4',3'-c]pyrimidine
Smiles: Clc1cc(ccc1Cl)CSc1nnc2n1c1sc3c(c1c1n2c(SCc2ccc(c(c2)Cl)Cl)nn1)CCN(C3)Cc1ccccc1
STK531165
Synonyms: (5E)-5-[(1-acetyl-1H-indol-3-yl)methylidene]-1-(3,4-dimethylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)/C(=C\c2cn(c3c2cccc3)C(=O)C)/C(=O)N1c1ccc(c(c1)C)C
STK531166
Synonyms: (6Z)-6-{3-chloro-5-ethoxy-4-[2-(2-methoxyphenoxy)ethoxy]benzylidene}-2-ethyl-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCOc1cc(cc(c1OCCOc1ccccc1OC)Cl)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)CC
STK531167
Synonyms: (6E)-5-imino-6-{2-[2-(3-methylphenoxy)ethoxy]benzylidene}-2-(trifluoromethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: Cc1cccc(c1)OCCOc1ccccc1/C=C\1/C(=O)N=c2n(C1=N)nc(s2)C(F)(F)F
STK531168
Synonyms: N-hexyl-2,2-dimethyl-5-(2-methylpropyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-amine
Smiles: CCCCCCNc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)CC(C)C
STK531169
Synonyms: 2-{[(3-chloroimidazo[1,2-a]pyridin-2-yl)methyl]sulfanyl}-1,3-benzothiazole
Smiles: Clc1c(CSc2nc3c(s2)cccc3)nc2n1cccc2
STK531170
Synonyms: 2-(heptylsulfanyl)-6-(propan-2-yl)-3-(prop-2-en-1-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: C=CCn1c(SCCCCCCC)nc2c(c1=O)c1CC(OCc1s2)C(C)C
STK531171
Synonyms: (3Z)-3-[3-(4-hydroxyphenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]-1-methyl-1,3-dihydro-2H-indol-2-one
Smiles: Oc1ccc(cc1)N1C(=S)S/C(=C\2/c3ccccc3N(C2=O)C)/C1=O
STK531173
Synonyms: 2-methoxy-N-(2-{(2E)-2-[(2-methyl-1H-indol-3-yl)methylidene]hydrazinyl}-2-oxoethyl)benzamide(non-preferredname)
Smiles: COc1ccccc1C(=O)NCC(=O)N/N=C/c1c(C)[nH]c2c1cccc2
STK531174
Synonyms: N-(2-{(2E)-2-[1-(furan-2-yl)ethylidene]hydrazinyl}-2-oxoethyl)-3,4,5-trimethoxybenzamide(non-preferredname)
Smiles: COc1c(OC)cc(cc1OC)C(=O)NCC(=O)N/N=C(/c1ccco1)\C
STK531178
Synonyms: 8-tert-butyl-1-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-4-(2-methylphenyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: Clc1ccc(cc1)C(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1C)CCC(C3)C(C)(C)C
STK531180
Synonyms: (5E)-3-[2-(2-chloro-10H-phenothiazin-10-yl)-2-oxoethyl]-5-(4-methoxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: COc1ccc(cc1)/C=C\1/SC(=S)N(C1=O)CC(=O)N1c2ccccc2Sc2c1cc(Cl)cc2
STK531181
Synonyms: 1-[(4-bromobenzyl)sulfanyl]-4-phenyl-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclopentan]-5(7H)-one
Smiles: Brc1ccc(cc1)CSc1nnc2n1c1c3ccccc3CC3(c1c(=O)n2c1ccccc1)CCCC3
STK531182
Synonyms: 4,4'-(ethane-1,2-diyldipiperazine-4,1-diyl)bis(benzo[g]quinoline)
Smiles: c1cc(N2CCN(CC2)CCN2CCN(CC2)c2ccnc3c2cc2ccccc2c3)c2c(n1)cc1c(c2)cccc1
STK531183
Synonyms: N-(2-{(2E)-2-[(2-methyl-1H-indol-3-yl)methylidene]hydrazinyl}-2-oxoethyl)pyridine-4-carboxamide(non-preferredname)
Smiles: O=C(CNC(=O)c1ccncc1)N/N=C/c1c(C)[nH]c2c1cccc2
STK531184
Synonyms: 5,7-dibromoquinolin-8-yl2-chlorobenzoate
Smiles: O=C(c1ccccc1Cl)Oc1c(Br)cc(c2c1nccc2)Br
STK531185
Synonyms: 2-(5-amino-1,3,4-thiadiazol-2-yl)-N'-[(E)-(3-chloro-5-methoxy-4-{2-[2-(2-methylphenoxy)ethoxy]ethoxy}phenyl)methylidene]acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)Cc2nnc(s2)N)cc(c1OCCOCCOc1ccccc1C)Cl
STK531186
Synonyms: 2-[3-(2-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]-N-(prop-2-en-1-yl)hydrazinecarbothioamide
Smiles: C=CCNC(=S)NNc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1OC)CCCCC3
STK531187
Synonyms: bis(2-methylpropyl)[hydroxy(phenyl)methyl]phosphonate
Smiles: OC(P(=O)(OCC(C)C)OCC(C)C)c1ccccc1
STK531188
Synonyms: ethylN-{(2Z)-3-(4-fluorophenyl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}leucinate
Smiles: CCOC(=O)C(NC(=O)/C(=C/c1ccc(cc1)F)/NC(=O)c1ccccc1)CC(C)C
STK531189
Synonyms: 4-tert-butyl-N-(2-{(2E)-2-[(2-methyl-1H-indol-3-yl)methylidene]hydrazinyl}-2-oxoethyl)benzamide(non-preferredname)
Smiles: O=C(CNC(=O)c1ccc(cc1)C(C)(C)C)N/N=C/c1c(C)[nH]c2c1cccc2
STK531190
Synonyms: 8-(4-methylphenyl)-9-(propylsulfanyl)-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: CCCSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CCc1c3cccc1
STK531191
Synonyms: 4-(2-methoxyphenyl)-1-(propylsulfanyl)-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CCCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1OC)CCC3
STK531192
Synonyms: 2-(1H-benzimidazol-2-yl)-N-[(E)-(2,4-dichlorophenyl)methylidene]aniline
Smiles: Clc1ccc(c(c1)Cl)/C=N/c1ccccc1c1nc2c([nH]1)cccc2
STK531193
Synonyms: N-(2,3-dimethylphenyl)-4-(3-methoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxamide
Smiles: COc1cccc(c1)C1NC(=S)NC(=C1C(=O)Nc1cccc(c1C)C)C
STK531194
Synonyms: 6-ethyl-6-methyl-3-(2-methylphenyl)-2-(methylsulfanyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCC1(C)OCc2c(C1)c1c(s2)nc(n(c1=O)c1ccccc1C)SC
STK531195
Synonyms: 2-(5-amino-1,3,4-thiadiazol-2-yl)-N'-[(E)-{3-iodo-5-methoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl}methylidene]acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)Cc2nnc(s2)N)cc(c1OCCOc1ccccc1C)I
STK531196
Synonyms: N,N-dimethyl-N'-(2,8,8-trimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)ethane-1,2-diamine
Smiles: CN(CCNc1nc(C)nc2c1sc1c2cc2c(n1)CC(OC2)(C)C)C
STK531198
Synonyms: N'-(9H-fluoren-9-ylidene)-1H-indole-3-carbohydrazide
Smiles: O=C(c1c[nH]c2c1cccc2)N/N=C/1\c2ccccc2c2c1cccc2
STK531200
Synonyms: methyl{[6-methyl-4-(4-methylphenyl)-5-oxo-4,5,6,7,8,9-hexahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}acetate
Smiles: COC(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)C)C(C)CCC3
STK531201
Synonyms: N-(5-{2-[(2E)-2-{2-[(4-chlorobenzyl)oxy]benzylidene}hydrazinyl]-2-oxoethyl}-1,3,4-thiadiazol-2-yl)-4-methylbenzamide
Smiles: O=C(Cc1nnc(s1)NC(=O)c1ccc(cc1)C)N/N=C/c1ccccc1OCc1ccc(cc1)Cl
STK531202
Synonyms: 3-methyl-1-(2-methyl-1H-imidazol-1-yl)-2-octylpyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCCCCCCCc1c(C)c(C#N)c2n(c1n1ccnc1C)c1ccccc1n2
STK531203
Synonyms: 4-[(5Z)-5-(4-ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-[5-(3-methylbenzyl)-1,3-thiazol-2-yl]butanamide
Smiles: CCc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCCC(=O)Nc1ncc(s1)Cc1cccc(c1)C
STK531204
Synonyms: 3,4-dimethoxy-N-(2-{(2E)-2-[(2-methyl-1H-indol-3-yl)methylidene]hydrazinyl}-2-oxoethyl)benzamide(non-preferredname)
Smiles: COc1cc(ccc1OC)C(=O)NCC(=O)N/N=C/c1c(C)[nH]c2c1cccc2
STK531205
Synonyms: 1-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-4-methyl-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Smiles: Brc1ccc(cc1)C(=O)CSc1nnc2n1c1c3ccccc3CC3(c1c(=O)n2C)CCCCC3
STK531206
Synonyms: 4-(furan-2-ylmethyl)-1-(propan-2-ylsulfanyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Smiles: CC(Sc1nnc2n1c1c3ccccc3CC3(c1c(=O)n2Cc1ccco1)CCCCC3)C
STK531207
Synonyms: (2Z)-N-{2-oxo-2-[(2E)-2-(1-phenylpropan-2-ylidene)hydrazinyl]ethyl}-3-phenylprop-2-enamide(non-preferredname)
Smiles: O=C(N/N=C(/Cc1ccccc1)\C)CNC(=O)/C=C\c1ccccc1
STK531209
Synonyms: 2-[(2E)-2-benzylidenehydrazinyl]-3-(4-methoxyphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: COc1ccc(cc1)n1c(N/N=C/c2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
STK531210
Synonyms: 1-(4-bromophenyl)-2-[(5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl)sulfanyl]ethanone
Smiles: CCCc1nc2sc3c(c2c2c1CCCC2)ncnc3SCC(=O)c1ccc(cc1)Br
STK531212
Synonyms: 4-methoxy-N-(5-{2-[(2E)-2-(4-methylbenzylidene)hydrazinyl]-2-oxoethyl}-1,3,4-thiadiazol-2-yl)benzamide
Smiles: COc1ccc(cc1)C(=O)Nc1nnc(s1)CC(=O)N/N=C/c1ccc(cc1)C
STK531213
Synonyms: N-(2-{(2E)-2-[1-(2,4-dimethoxyphenyl)ethylidene]hydrazinyl}-2-oxoethyl)pyridine-3-carboxamide(non-preferredname)
Smiles: COc1cc(OC)ccc1/C(=N/NC(=O)CNC(=O)c1cccnc1)/C
STK531214
Synonyms: 5,7-dimethyl-2-(2-methylphenyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Smiles: O=C1C2(C)CN3CC1(C)CN(C2)C3c1ccccc1C
STK531215
Synonyms: 2-(3,4-dihydroxyphenyl)-5,7-diethyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Smiles: CCC12CN3CC(C2=O)(CN(C1)C3c1ccc(c(c1)O)O)CC
STK531216
Synonyms: 2-{8-[4-(2-hydroxyethyl)piperazin-1-yl]-3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-1-yl}ethyl3,4,5-trimethoxybenzoate
Smiles: OCCN1CCN(CC1)c1nc2c(n1C)c(=O)n(c(=O)n2C)CCOC(=O)c1cc(OC)c(c(c1)OC)OC
STK531217
Synonyms: 4-(2-methoxyphenyl)-7,7-dimethyl-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: COc1ccccc1n1c(=O)c2c3CC(C)(C)OCc3sc2n2c1nnc2
STK531220
Synonyms: 2-methoxy-5-{(E)-[2-(pyridin-2-yl)hydrazinylidene]methyl}phenol
Smiles: COc1ccc(cc1O)/C=N/Nc1ccccn1
STK531221
Synonyms: 2-(3-benzyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)-N-ethylhydrazinecarbothioamide
Smiles: CCNC(=S)NNc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCCC3
STK531222
Synonyms: (6Z)-2-ethyl-5-imino-6-[3-methoxy-4-(1-phenylethoxy)benzylidene]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: COc1cc(ccc1OC(c1ccccc1)C)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)CC
STK531223
Synonyms: N-(2-{(2Z)-2-[1-(furan-2-yl)ethylidene]hydrazinyl}-2-oxoethyl)furan-2-carboxamide(non-preferredname)
Smiles: O=C(N/N=C(\c1ccco1)/C)CNC(=O)c1ccco1
STK531224
Synonyms: N-(2-{(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl}-2-oxoethyl)pyridine-3-carboxamide(non-preferredname)
Smiles: O=C(CNC(=O)c1cccnc1)N/N=C(\c1ccc(cc1)Cl)/C
STK531225
Synonyms: diethyl{[4-(dimethylamino)phenyl](hydroxy)methyl}phosphonate
Smiles: CCOP(=O)(C(c1ccc(cc1)N(C)C)O)OCC
STK531227
Synonyms: 3-{2-[(E)-2-(3-nitrophenyl)ethenyl]-4-oxoquinazolin-3(4H)-yl}benzoicacid
Smiles: [O-][N+](=O)c1cccc(c1)/C=C/c1nc2ccccc2c(=O)n1c1cccc(c1)C(=O)O
STK531228
Synonyms: N'-[2,2-dimethyl-5-(propan-2-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]-N,N-dimethylethane-1,2-diamine
Smiles: CN(CCNc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)C(C)C)C
STK531229
Synonyms: 1-(4-chlorophenyl)-2-[(5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl)sulfanyl]ethanone
Smiles: CCCc1nc2sc3c(c2c2c1CCCC2)ncnc3SCC(=O)c1ccc(cc1)Cl
STK531230
Synonyms: 2-[(E)-(cyclohexylimino)methyl]phenol
Smiles: Oc1ccccc1/C=N/C1CCCCC1
STK531231
Synonyms: N-[2-(dimethylamino)ethyl]tricyclo[4.3.1.1~3,8~]undecane-1-carboxamide
Smiles: CN(CCNC(=O)C12CC3CCC(C1)CC(C2)C3)C
STK531233
Synonyms: 8,8-dimethyl-3-octyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: CCCCCCCCn1cnc2c(c1=O)sc1c2cc2c(n1)CC(OC2)(C)C
STK531234
Synonyms: 2-(1H-benzimidazol-2-yl)-N-[(E)-(3-nitrophenyl)methylidene]aniline
Smiles: [O-][N+](=O)c1cccc(c1)/C=N/c1ccccc1c1nc2c([nH]1)cccc2
STK531235
Synonyms: 1-(benzylsulfanyl)-4-(2-methoxyphenyl)-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: COc1ccccc1n1c2nnc(n2c2c(c1=O)c1CCCc1s2)SCc1ccccc1
STK531236
Synonyms: 3-methyl-1-[(4-methylphenyl)amino]-2-octylpyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCCCCCCCc1c(C)c(C#N)c2n(c1Nc1ccc(cc1)C)c1ccccc1n2
STK531237
Synonyms: 2,2'-(ethane-1,2-diyldisulfanediyl)bis[3-(4-methoxyphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one]
Smiles: COc1ccc(cc1)n1c(SCCSc2nc3c4ccccc4CC4(c3c(=O)n2c2ccc(cc2)OC)CCCCC4)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
STK531238
Synonyms: 4-{(2E)-2-[1-(4-ethoxyphenyl)ethylidene]hydrazinyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Smiles: CCOc1ccc(cc1)/C(=N/Nc1ncnc2c1c1CCCCc1s2)/C
STK531240
Synonyms: 4-[(5Z)-5-(4-ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-{5-[3-(trifluoromethyl)benzyl]-1,3-thiazol-2-yl}butanamide
Smiles: CCc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCCC(=O)Nc1ncc(s1)Cc1cccc(c1)C(F)(F)F
STK531241
Synonyms: N'-[3-(4-methoxyphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]benzohydrazide
Smiles: COc1ccc(cc1)n1c(NNC(=O)c2ccccc2)nc2c(c1=O)c1CCCCc1s2
STK531242
Synonyms: 1,7,7-trimethyl-4-(2-methylphenyl)-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: Cc1ccccc1n1c(=O)c2c3CC(C)(C)OCc3sc2n2c1nnc2C
STK531243
Synonyms: N-[5-(2-{(2E)-2-[4-(2-bromoethoxy)benzylidene]hydrazinyl}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]-4-methoxybenzamide
Smiles: BrCCOc1ccc(cc1)/C=N/NC(=O)Cc1nnc(s1)NC(=O)c1ccc(cc1)OC
STK531244
Synonyms: 2-[3-(4-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]-N-(2-methylprop-2-en-1-yl)hydrazinecarbothioamide
Smiles: COc1ccc(cc1)n1c(NNC(=S)NCC(=C)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
STK531245
Synonyms: 2-[(E)-(1-ethyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-6-iodo-3-(3-methoxyphenyl)quinazolin-4(3H)-one
Smiles: CCN1C(=O)/C(=C/c2nc3ccc(cc3c(=O)n2c2cccc(c2)OC)I)/c2c1cccc2
STK531246
Synonyms: N-{[2-(3-benzyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)hydrazinyl]carbonothioyl}benzamide
Smiles: S=C(NC(=O)c1ccccc1)NNc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCCC3
STK531247
Synonyms: 2-(butylsulfanyl)-7-methyl-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CCCCSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCC(C3)C
STK531249
Synonyms: 1,1'-(3',5-dimethylbiphenyl-3,4'-diyl)bis{3-[3-(propan-2-yloxy)phenyl]pyrrolidine-2,5-dione}
Smiles: CC(Oc1cccc(c1)C1CC(=O)N(C1=O)c1cc(C)cc(c1)c1ccc(c(c1)C)N1C(=O)CC(C1=O)c1cccc(c1)OC(C)C)C
STK531250
Synonyms: 3-(3-methylphenyl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: Cc1cccc(c1)n1c(SCC(=O)c2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
STK531253
Synonyms: (5Z)-5-(4-chlorobenzylidene)-3-[3-(2-chloro-10H-phenothiazin-10-yl)-3-oxopropyl]-2-thioxo-1,3-thiazolidin-4-one
Smiles: Clc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCC(=O)N1c2ccccc2Sc2c1cc(Cl)cc2
STK531254
Synonyms: 2-(5-amino-1,3,4-thiadiazol-2-yl)-N'-[(E)-{3-iodo-5-methoxy-4-[2-(4-methylphenoxy)ethoxy]phenyl}methylidene]acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)Cc2nnc(s2)N)cc(c1OCCOc1ccc(cc1)C)I
STK531255
Synonyms: diethyl[hydroxy(pyridin-3-yl)methyl]phosphonate
Smiles: CCOP(=O)(C(c1cccnc1)O)OCC
STK531256
Synonyms: 7,7-dimethyl-1-[(2-oxo-2-phenylethyl)sulfanyl]-4-phenyl-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: O=C(c1ccccc1)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CC(OC3)(C)C
STK531258
Synonyms: diethyl(2,2,2-trichloro-1-{[(2,4-dichlorophenyl)carbonyl]amino}ethyl)phosphonate
Smiles: CCOP(=O)(C(C(Cl)(Cl)Cl)NC(=O)c1ccc(cc1Cl)Cl)OCC
STK531260
Synonyms: 5-methyl-2-(propan-2-yl)cyclohexylP-[4-(dimethylamino)phenyl]-N-[3-(trifluoromethyl)phenyl]phosphonamidate
Smiles: CC1CCC(C(C1)OP(=O)(c1ccc(cc1)N(C)C)Nc1cccc(c1)C(F)(F)F)C(C)C
STK531263
Synonyms: 1-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-4-(4-methylphenyl)-7-(propan-2-yl)-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: Cc1ccc(cc1)n1c(=O)c2c3CC(OCc3sc2n2c1nnc2SCC(=O)c1ccc(cc1)Cl)C(C)C
STK531265
Synonyms: 8-[(3,4-dichlorobenzyl)sulfanyl]-5-(morpholin-4-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: Clc1ccc(cc1Cl)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1
STK531267
Synonyms: 2-(5-amino-1,3,4-thiadiazol-2-yl)-N'-[(E)-(3,5-dichloro-4-{2-[5-methyl-2-(propan-2-yl)phenoxy]ethoxy}phenyl)methylidene]acetohydrazide
Smiles: O=C(Cc1nnc(s1)N)N/N=C/c1cc(Cl)c(c(c1)Cl)OCCOc1cc(C)ccc1C(C)C
STK531268
Synonyms: 4-(2-methoxyphenyl)-1-(methylsulfanyl)-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: COc1ccccc1n1c(=O)c2c3CCCc3sc2n2c1nnc2SC
STK531269
Synonyms: bis({2-[(diphenylphosphoryl)methyl]phenoxy}methyl)phosphinicacid
Smiles: OP(=O)(COc1ccccc1CP(=O)(c1ccccc1)c1ccccc1)COc1ccccc1CP(=O)(c1ccccc1)c1ccccc1
STK531270
Synonyms: (2E)-N-(2-{(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl}-2-oxoethyl)-3-(2-methoxyphenyl)prop-2-enamide(non-preferredname)
Smiles: COc1ccccc1/C=C/C(=O)NCC(=O)N/N=C(\c1ccc(cc1)Cl)/C
STK531271
Synonyms: N-methyl-2-(4-oxo-3-phenyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)hydrazinecarbothioamide
Smiles: CNC(=S)NNc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1)CCCCC3
STK531272
Synonyms: 2-[(3,4-dichlorobenzyl)sulfanyl]-3-(4-methylphenyl)-7-propyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CCCN1CCc2c(C1)sc1c2c(=O)n(c(n1)SCc1ccc(c(c1)Cl)Cl)c1ccc(cc1)C
STK531273
Synonyms: 2-[(Z)-(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-3-(2,6-dichlorophenyl)quinazolin-4(3H)-one
Smiles: Brc1ccc2c(c1)/C(=C/c1nc3ccccc3c(=O)n1c1c(Cl)cccc1Cl)/C(=O)N2
STK531274
Synonyms: N-{2-[(2E)-2-(2,4-dihydroxybenzylidene)hydrazinyl]-2-oxoethyl}-2-phenoxyacetamide(non-preferredname)
Smiles: O=C(CNC(=O)COc1ccccc1)N/N=C/c1ccc(cc1O)O
STK531276
Synonyms: N-(9,10-dioxo-8a,9,10,10a-tetrahydroanthracen-1-yl)-9-oxo-9H-fluorene-1-carboxamide
Smiles: O=C1C2C=CC=CC2C(=O)c2c1c(ccc2)NC(=O)c1cccc2c1C(=O)c1c2cccc1
STK531278
Synonyms: 2,2-dimethyl-5-(morpholin-4-yl)-8-(octylsulfanyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CCCCCCCCSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1
STK531282
Synonyms: N-(cyclopentylmethyl)-5-(furan-2-yl)-2,2-dimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-amine
Smiles: CC1(C)OCc2c(C1)c1c(nc2c2ccco2)sc2c1ncnc2NCC1CCCC1
STK531283
Synonyms: 8-ethyl-8-methyl-3-(2-methylphenyl)-2-(methylsulfanyl)-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Smiles: CCC1(C)OCc2c(C1)nc1c(c2)c(=O)n(c(n1)SC)c1ccccc1C
STK531284
Synonyms: 3-(2-methylphenyl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CC(C1OCc2c(C1)c1c(s2)nc(n(c1=O)c1ccccc1C)SCC(=O)c1ccccc1)C
STK531285
Synonyms: N-benzyl-2-[3-(4-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]hydrazinecarbothioamide
Smiles: S=C(NNc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)C)CCCCC3)NCc1ccccc1
STK531286
Synonyms: 4-tert-butyl-N-(2-{(2Z)-2-[1-(furan-2-yl)ethylidene]hydrazinyl}-2-oxoethyl)benzamide(non-preferredname)
Smiles: O=C(N/N=C(\c1ccco1)/C)CNC(=O)c1ccc(cc1)C(C)(C)C
STK531287
Synonyms: dipropan-2-yl[1,3-benzodioxol-5-yl(phenylamino)methyl]phosphonate
Smiles: CC(OP(=O)(C(c1ccc2c(c1)OCO2)Nc1ccccc1)OC(C)C)C
STK531288
Synonyms: 2-methoxy-4-[(Z)-{2-[(5-{[(4-methoxyphenyl)carbonyl]amino}-1,3,4-thiadiazol-2-yl)acetyl]hydrazinylidene}methyl]phenyl4-fluorobenzoate
Smiles: COc1cc(/C=N\NC(=O)Cc2nnc(s2)NC(=O)c2ccc(cc2)OC)ccc1OC(=O)c1ccc(cc1)F
STK531289
Synonyms: 4-bromo-2-[(E)-(2-{[(furan-2-ylcarbonyl)amino]acetyl}hydrazinylidene)methyl]phenyl(2E)-3-(furan-2-yl)prop-2-enoate(non-preferredname)
Smiles: O=C(CNC(=O)c1ccco1)N/N=C/c1cc(Br)ccc1OC(=O)/C=C/c1ccco1
STK531290
Synonyms: 3-methyl-2-[(2-methylprop-2-en-1-yl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CC(=C)CSc1nc2c3ccccc3CC3(c2c(=O)n1C)CCCCC3
STK531291
Synonyms: N-(4-methylphenyl)-2-{[5-oxo-4-phenyl-7-(propan-2-yl)-4,5,6,9-tetrahydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CC(OC3)C(C)C
STK531292
Synonyms: (2Z,2'Z)-2,2'-[(1Z,5Z)-1,5-bis(4-bromophenyl)pentane-1,5-diylidene]dihydrazinecarboxamide
Smiles: NC(=O)N/N=C(\c1ccc(cc1)Br)/CCC/C(=N/NC(=O)N)/c1ccc(cc1)Br
STK531293
Synonyms: 2,2,11,11-tetrakis(4-methoxyphenyl)-2,11-dihydrobenzo[f]pyrano[3,2-h]chromene
Smiles: COc1ccc(cc1)C1(C=Cc2c(O1)c1OC(C=Cc1c1c2cccc1)(c1ccc(cc1)OC)c1ccc(cc1)OC)c1ccc(cc1)OC
STK531294
Synonyms: (6Z)-2-ethyl-6-{4-[(2-fluorobenzyl)oxy]benzylidene}-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCc1nn2c(=NC(=O)/C(=C\c3ccc(cc3)OCc3ccccc3F)/C2=N)s1
STK531295
Synonyms: N-(4-nitrophenyl)phenazine-1-carboxamide
Smiles: O=C(c1cccc2c1nc1ccccc1n2)Nc1ccc(cc1)[N+](=O)[O-]
STK531296
Synonyms: N-({2-[3-(2-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]hydrazinyl}carbonothioyl)benzamide
Smiles: S=C(NC(=O)c1ccccc1)NNc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCCC3
STK531297
Synonyms: 2-(dimethylamino)ethyl3-[(5E)-4-oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]propanoate
Smiles: CN(CCOC(=O)CCN1C(=S)S/C(=C/c2cccs2)/C1=O)C
STK531298
Synonyms: N-{2-oxo-2-[(2E)-2-(1-phenylpropan-2-ylidene)hydrazinyl]ethyl}-3-phenylpropanamide(non-preferredname)
Smiles: O=C(N/N=C(/Cc1ccccc1)\C)CNC(=O)CCc1ccccc1
STK531299
Synonyms: N-(furan-2-ylmethyl)-2-[3-(2-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]hydrazinecarbothioamide
Smiles: S=C(NNc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCCC3)NCc1ccco1
STK531300
Synonyms: 2-[2-(2-hydroxypropyl)-5-methylhexanoyl]-N-phenylhydrazinecarbothioamide
Smiles: CC(CC(C(=O)NNC(=S)Nc1ccccc1)CCC(C)C)O
STK531301
Synonyms: bis[5-methyl-2-(propan-2-yl)cyclohexyl][(4-bromophenyl)(hydroxy)methyl]phosphonate
Smiles: CC1CCC(C(C1)OP(=O)(C(c1ccc(cc1)Br)O)OC1CC(C)CCC1C(C)C)C(C)C
STK531302
Synonyms: ethyl4'-{[(4-bromophenyl)carbonyl]amino}-1'H-spiro[cyclohexane-1,2'-naphthalene]-3'-carboxylate
Smiles: CCOC(=O)C1=C(NC(=O)c2ccc(cc2)Br)c2ccccc2CC21CCCCC2
STK531303
Synonyms: 2,2-dimethyl-8-[(2-phenylethyl)sulfanyl]-5-propyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CCCc1nc2sc3c(c2c2c1COC(C2)(C)C)ncnc3SCCc1ccccc1
STK531304
Synonyms: N-[5-(2-{(2E)-2-[3-ethoxy-4-(naphthalen-1-ylmethoxy)benzylidene]hydrazinyl}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]benzamide
Smiles: CCOc1cc(/C=N/NC(=O)Cc2nnc(s2)NC(=O)c2ccccc2)ccc1OCc1cccc2c1cccc2
STK531305
Synonyms: 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-(2-methylphenyl)-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CC(C1OCc2c(C1)c1c(s2)nc(n(c1=O)c1ccccc1C)SCC(=O)c1ccc(cc1)Br)C
STK531306
Synonyms: 6-chloro-4-methyl-2-oxo-2H-chromen-7-ylN-[(4-methylphenyl)sulfonyl]alaninate
Smiles: Cc1ccc(cc1)S(=O)(=O)NC(C(=O)Oc1cc2oc(=O)cc(c2cc1Cl)C)C
STK531307
Synonyms: ethyl4'-({[(3-benzyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)sulfanyl]acetyl}amino)-1'H-spiro[cyclohexane-1,2'-naphthalene]-3'-carboxylate
Smiles: CCOC(=O)C1=C(NC(=O)CSc2nc3c4ccccc4CC4(c3c(=O)n2Cc2ccccc2)CCCCC4)c2c(CC31CCCCC3)cccc2
STK531309
Synonyms: 2-bromo-N'-[3-(2-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]benzohydrazide
Smiles: COc1ccccc1n1c(NNC(=O)c2ccccc2Br)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
STK531310
Synonyms: N-[(2Z)-3-(4-bromophenyl)-2-{[(2-methoxyphenyl)carbonyl]amino}prop-2-enoyl]leucine
Smiles: COc1ccccc1C(=O)N/C(=C\c1ccc(cc1)Br)/C(=O)NC(C(=O)O)CC(C)C
STK531312
Synonyms: 3-(4-nitrophenyl)-2-propylquinazolin-4(3H)-one
Smiles: CCCc1nc2ccccc2c(=O)n1c1ccc(cc1)[N+](=O)[O-]
STK531314
Synonyms: N-[5-(2-{(2E)-2-[5-chloro-2-(naphthalen-1-ylmethoxy)benzylidene]hydrazinyl}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]-2-methylbenzamide
Smiles: O=C(Cc1nnc(s1)NC(=O)c1ccccc1C)N/N=C/c1cc(Cl)ccc1OCc1cccc2c1cccc2
STK531316
Synonyms: 3-benzyl-2-[2-(2-oxohexyl)hydrazinyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: CCCCC(=O)CNNc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCC3
STK531317
Synonyms: 1-(6,6-dimethyl-5,7-dinitro-1,3-diazatricyclo[3.3.1.1~3,7~]dec-2-yl)butane-1,2,3,4-tetrol
Smiles: OCC(C(C(C1N2CC3(CN1CC(C2)(C3(C)C)[N+](=O)[O-])[N+](=O)[O-])O)O)O
STK531318
Synonyms: N,N'-(5,5-dioxidodibenzo[b,d]thiene-3,7-diyl)bis(4-nitrobenzamide)
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])Nc1ccc2c(c1)S(=O)(=O)c1c2ccc(c1)NC(=O)c1ccc(cc1)[N+](=O)[O-]
STK531319
Synonyms: 2-(3,4-dihydroxyphenyl)-5,7-dipropyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Smiles: CCCC12CN3CC(C2=O)(CN(C1)C3c1ccc(c(c1)O)O)CCC
STK531320
Synonyms: N-(2-{(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl}-2-oxoethyl)-3,4,5-trimethoxybenzamide(non-preferredname)
Smiles: COc1cc(cc(c1OC)OC)C(=O)NCC(=O)N/N=C(\c1ccc(cc1)Cl)/C
STK531321
Synonyms: bis[5-methyl-2-(propan-2-yl)cyclohexyl]{phenyl[(1-phenylethyl)amino]methyl}phosphonate
Smiles: CC1CCC(C(C1)OP(=O)(C(c1ccccc1)NC(c1ccccc1)C)OC1CC(C)CCC1C(C)C)C(C)C
STK531322
Synonyms: N,N-dibenzyl-2,2-dimethyl-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-amine
Smiles: CC1(C)OCc2c(C1)c1c(nc2N2CCOCC2)sc2c1ncnc2N(Cc1ccccc1)Cc1ccccc1
STK531323
Synonyms: 2-methoxy-4-{(E)-[2-({5-[(phenylcarbonyl)amino]-1,3,4-thiadiazol-2-yl}acetyl)hydrazinylidene]methyl}phenyl4-methylbenzenesulfonate
Smiles: COc1cc(/C=N/NC(=O)Cc2nnc(s2)NC(=O)c2ccccc2)ccc1OS(=O)(=O)c1ccc(cc1)C
STK531324
Synonyms: 4-bromo-N'-[3-(2-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]benzohydrazide
Smiles: COc1ccccc1n1c(NNC(=O)c2ccc(cc2)Br)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
STK531325
Synonyms: 6-{(2E)-2-[3-chloro-5-ethoxy-4-(naphthalen-1-ylmethoxy)benzylidene]hydrazinyl}-N,N,N',N'-tetramethylpyrimidine-2,4-diamine
Smiles: CCOc1cc(/C=N/Nc2cc(nc(n2)N(C)C)N(C)C)cc(c1OCc1cccc2c1cccc2)Cl
STK531327
Synonyms: 3-(4-methoxyphenyl)-7-methyl-2-[(2-phenylethyl)sulfanyl]-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: COc1ccc(cc1)n1c(SCCc2ccccc2)nc2c(c1=O)c1CCN(Cc1s2)C
STK531330
Synonyms: ethyl2-[2-(ethylsulfanyl)propyl]-4,6-dioxocyclohexanecarboxylate
Smiles: CCSC(CC1CC(=O)CC(=O)C1C(=O)OCC)C
STK531332
Synonyms: 3-(9H-carbazol-9-yl)-N'-(3-methylbut-3-enethioyl)propanehydrazide
Smiles: CC(=C)CC(=S)NNC(=O)CCn1c2ccccc2c2c1cccc2
STK531335
Synonyms: 2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-(4-methylphenyl)-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CC(C1OCc2c(C1)c1c(s2)nc(n(c1=O)c1ccc(cc1)C)SCC(=O)c1ccc(cc1)Cl)C
STK531336
Synonyms: 2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-(4-methoxyphenyl)-7-methyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)Cl)nc2c(c1=O)c1CCN(Cc1s2)C
STK531337
Synonyms: ethyl[(3-benzyl-5-cyclohexyl-5-methyl-4-oxo-3,4,5,6-tetrahydrobenzo[h]quinazolin-2-yl)sulfanyl]acetate
Smiles: CCOC(=O)CSc1nc2c3ccccc3CC(c2c(=O)n1Cc1ccccc1)(C)C1CCCCC1
STK531338
Synonyms: (2E)-3-(4-methoxyphenyl)-N-{2-oxo-2-[(2E)-2-(1-phenylpropan-2-ylidene)hydrazinyl]ethyl}prop-2-enamide(non-preferredname)
Smiles: COc1ccc(cc1)/C=C/C(=O)NCC(=O)N/N=C(/Cc1ccccc1)\C
STK531339
Synonyms: 2-(heptylsulfanyl)-3-(2-methylphenyl)-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCCCCCCSc1nc2sc3c(c2c(=O)n1c1ccccc1C)CC(OC3)C(C)C
STK531340
Synonyms: 8,8-dimethyl-3-(4-methylphenyl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Smiles: Cc1ccc(cc1)n1c(SCC(=O)c2ccccc2)nc2c(c1=O)cc1c(n2)CC(OC1)(C)C
STK531341
Synonyms: (6Z)-6-[3,5-dichloro-4-(2-phenoxyethoxy)benzylidene]-2-ethyl-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCc1nn2c(=NC(=O)/C(=C\c3cc(Cl)c(c(c3)Cl)OCCOc3ccccc3)/C2=N)s1
STK531342
Synonyms: 8-(heptylsulfanyl)-2,2-dimethyl-5-propyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CCCCCCCSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)CCC
STK531344
Synonyms: 4-[(5Z)-5-(4-ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-(3-iodophenyl)butanamide
Smiles: CCc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCCC(=O)Nc1cccc(c1)I
STK531345
Synonyms: 8-[(3,4-dichlorobenzyl)sulfanyl]-2,3-dimethyl-5-phenylthieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-4(5H)-one
Smiles: Clc1cc(ccc1Cl)CSc1nnc2n1c1sc(c(c1c(=O)n2c1ccccc1)C)C
STK531346
Synonyms: (2E)-N-(2-{(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl}-2-oxoethyl)-3-(4-methoxyphenyl)prop-2-enamide(non-preferredname)
Smiles: COc1ccc(cc1)/C=C/C(=O)NCC(=O)N/N=C(\c1ccc(cc1)Cl)/C
STK531347
Synonyms: 2-{[2,2-dimethyl-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]sulfanyl}-N-(4-methylphenyl)acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1
STK531348
Synonyms: methyl{[3-(4-methoxyphenyl)-8,8-dimethyl-4-oxo-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
Smiles: COC(=O)CSc1nc2nc3CC(C)(C)OCc3cc2c(=O)n1c1ccc(cc1)OC
STK531350
Synonyms: 2-(hexylsulfanyl)-3-(2-methylphenyl)-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one
Smiles: CCCCCCSc1nc2nc3CCCCc3cc2c(=O)n1c1ccccc1C
STK531352
Synonyms: 3-(2-methylphenyl)-6-(propan-2-yl)-2-(propan-2-ylsulfanyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CC(Sc1nc2sc3c(c2c(=O)n1c1ccccc1C)CC(OC3)C(C)C)C
STK531353
Synonyms: 2-(ethylsulfanyl)-5-methyl-3-(4-methylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CCSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)C(C)CCC3
STK531354
Synonyms: N'-{(E)-[1-(2-chlorobenzyl)-1H-indol-3-yl]methylidene}pyridine-4-carbohydrazide
Smiles: O=C(c1ccncc1)N/N=C/c1cn(c2c1cccc2)Cc1ccccc1Cl
STK531355
Synonyms: 2-(5-bromo-2-hydroxyphenyl)-5,7-dipropyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Smiles: CCCC12CN3CC(C2=O)(CN(C1)C3c1cc(Br)ccc1O)CCC
STK531356
Synonyms: 2,2-dimethyl-8-[(2-methylprop-2-en-1-yl)sulfanyl]-5-propyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CCCc1nc2sc3c(c2c2c1COC(C2)(C)C)ncnc3SCC(=C)C
STK531358
Synonyms: 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-phenyl-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CC(C1OCc2c(C1)c1c(s2)nc(n(c1=O)c1ccccc1)SCC(=O)c1ccc(cc1)Br)C
STK531359
Synonyms: 8-tert-butyl-4-(2-methylphenyl)-1-[(2-oxo-2-phenylethyl)sulfanyl]-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: O=C(c1ccccc1)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1C)CCC(C3)C(C)(C)C
STK531360
Synonyms: 3-amino-7-tert-butyl-2-(dec-9-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: C=CCCCCCCCCc1nc2sc3c(c2c(=O)n1N)CCC(C3)C(C)(C)C
STK531362
Synonyms: 8-methyl-4-(4-methylphenyl)-1-[(2-methylprop-2-en-1-yl)sulfanyl]-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CC(=C)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)C)CCN(C3)C
STK531364
Synonyms: (6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)(4-nitrophenyl)methanone
Smiles: COc1cc2CN(CCc2cc1OC)C(=O)c1ccc(cc1)[N+](=O)[O-]
STK531365
Synonyms: pentyl{[3-(2-methylphenyl)-4-oxo-3,4,6,7,8,9-hexahydropyrimido[4,5-b]quinolin-2-yl]sulfanyl}acetate
Smiles: CCCCCOC(=O)CSc1nc2nc3CCCCc3cc2c(=O)n1c1ccccc1C
STK531366
Synonyms: 3-(2-methylphenyl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: O=C(c1ccccc1)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCCC3
STK531368
Synonyms: 2-(pentylsulfanyl)-3-phenyl-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCCCCSc1nc2sc3c(c2c(=O)n1c1ccccc1)CC(OC3)C(C)C
STK531369
Synonyms: 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-8-ethyl-8-methyl-3-(2-methylphenyl)-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Smiles: CCC1(C)OCc2c(C1)nc1c(c2)c(=O)n(c(n1)SCC(=O)c1ccc(cc1)Br)c1ccccc1C
STK531370
Synonyms: N'-[(1,3-benzothiazol-2-ylsulfanyl)acetyl]-4-[(5Z)-5-(4-ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanehydrazide
Smiles: CCc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCCC(=O)NNC(=O)CSc1nc2c(s1)cccc2
STK531372
Synonyms: 2,2-dimethyl-5-(morpholin-4-yl)-9-phenyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8(9H)-one
Smiles: O=c1c2sc3c(c2ncn1c1ccccc1)c1CC(C)(C)OCc1c(n3)N1CCOCC1
STK531373
Synonyms: 1-imino-9,9-dimethyl-2,5-diphenyl-3-(prop-2-en-1-ylsulfanyl)-1,2,5,7,9,10-hexahydro-6H-pyrano[4',3':4,5]pyrido[2,3-d]pyrimidine-6-thione
Smiles: C=CCSc1nc2n(c3ccccc3)c(=S)c3c(c2c(=N)n1c1ccccc1)CC(OC3)(C)C
STK531374
Synonyms: 8-(hexylsulfanyl)-5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: CCCCCCSc1ncnc2c1sc1c2c2CCCCc2c(n1)CCC
STK531375
Synonyms: 2-{[5-(propan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]sulfanyl}acetamide
Smiles: NC(=O)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)C(C)C
STK531376
Synonyms: 2-(hexylsulfanyl)-3-(2-methylphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: CCCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCC3
STK531378
Synonyms: 3-(4-methoxyphenyl)-8,8-dimethyl-2-[(3-methylbutyl)sulfanyl]-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Smiles: COc1ccc(cc1)n1c(SCCC(C)C)nc2c(c1=O)cc1c(n2)CC(OC1)(C)C
STK531379
Synonyms: methyl2-{[2,2-dimethyl-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]sulfanyl}propanoate
Smiles: COC(=O)C(Sc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1)C
STK531380
Synonyms: 2-(ethylsulfanyl)-3-(4-methoxyphenyl)-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CCSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)OC)CCC(C3)C
STK531381
Synonyms: 2-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-5,7-dimethylimidazo[1,2-a]pyrimidine
Smiles: Cc1nc(SCc2nc3n(c2)c(C)cc(n3)C)nc(c1)C
STK531382
Synonyms: N-(2-{(2Z)-2-[1-(3,4-dichlorophenyl)ethylidene]hydrazinyl}-2-oxoethyl)-2-phenoxyacetamide(non-preferredname)
Smiles: O=C(N/N=C(\c1ccc(c(c1)Cl)Cl)/C)CNC(=O)COc1ccccc1
STK531383
Synonyms: N,N-dimethyl-N'-[5-(morpholin-4-yl)-1,2,3,4-tetrahydro[1,2,3]triazino[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]ethane-1,2-diamine
Smiles: CN(CCNc1nnnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1)C
STK531384
Synonyms: 3-methyl-1-[(3-methylphenyl)amino]-2-octylpyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCCCCCCCc1c(C)c(C#N)c2n(c1Nc1cccc(c1)C)c1ccccc1n2
STK531385
Synonyms: 3-bromo-2-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}imidazo[1,2-a]pyrimidine
Smiles: Brc1c(CSc2nnnn2c2ccccc2)nc2n1cccn2
STK531387
Synonyms: 8-(methylsulfanyl)-5-(morpholin-4-yl)-1,2,3,4-tetrahydro[1,2,3]triazino[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: CSc1nnnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1
STK531388
Synonyms: 4-fluoro-N-{2-oxo-2-[(2E)-2-(1-phenylpropan-2-ylidene)hydrazinyl]ethyl}benzamide(non-preferredname)
Smiles: O=C(N/N=C(/Cc1ccccc1)\C)CNC(=O)c1ccc(cc1)F
STK531389
Synonyms: 8-(2-ethoxyphenyl)-9-(methylsulfanyl)-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: CCOc1ccccc1n1c(SC)nc2c(c1=O)c1CCc3c(c1s2)cccc3
STK531390
Synonyms: 11-(hexadecylamino)-2,3-dihydro-1H-cyclopenta[4,5]pyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCCCCCCCCCCCCCCCNc1c2CCCc2c(c2n1c1ccccc1n2)C#N
STK531391
Synonyms: 4-bromo-N'-{4-[(5Z)-5-(4-ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}benzohydrazide
Smiles: CCc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCCC(=O)NNC(=O)c1ccc(cc1)Br
STK531392
Synonyms: 1-[(2,4-dinitrophenyl)amino]-3-(4-ethoxyphenyl)pyrrolidine-2,5-dione
Smiles: CCOc1ccc(cc1)C1CC(=O)N(C1=O)Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
STK531394
Synonyms: (1E,6E)-N,N'-dihydroxy-1,6-bis[4-(pentyloxy)phenyl]hexane-1,6-diimine
Smiles: CCCCCOc1ccc(cc1)/C(=N/O)/CCCC/C(=N\O)/c1ccc(cc1)OCCCCC
STK531395
Synonyms: 2-[(naphthalen-1-ylmethyl)sulfanyl]-6-(propan-2-yl)-3-(prop-2-en-1-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: C=CCn1c(SCc2cccc3c2cccc3)nc2c(c1=O)c1CC(OCc1s2)C(C)C
STK531397
Synonyms: butyl4-({4-[(5Z)-5-(4-ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}amino)benzoate
Smiles: CCCCOC(=O)c1ccc(cc1)NC(=O)CCCN1C(=S)S/C(=C\c2ccc(cc2)CC)/C1=O
STK531398
Synonyms: 8-[(3,4-dichlorobenzyl)sulfanyl]-2,2-dimethyl-5-propyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CCCc1nc2sc3c(c2c2c1COC(C2)(C)C)ncnc3SCc1ccc(c(c1)Cl)Cl
STK531400
Synonyms: N,N-diethyl-N'-[5-(morpholin-4-yl)-1,2,3,4-tetrahydro[1,2,3]triazino[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]ethane-1,2-diamine
Smiles: CCN(CCNc1nnnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1)CC
STK531406
Synonyms: 4-fluoro-N-[4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,3-thiazol-2-yl]benzamide
Smiles: Fc1ccc(cc1)C(=O)Nc1scc(n1)C12CC3CC(C2)CC(C1)C3
STK531407
Synonyms: (5E)-1-(3,4-dimethylphenyl)-5-(1H-indol-3-ylmethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)/C(=C\c2c[nH]c3c2cccc3)/C(=O)N1c1ccc(c(c1)C)C
STK531408
Synonyms: (2Z)-3-(2-methoxyphenyl)-N-{2-oxo-2-[(2E)-2-(1-phenylpropan-2-ylidene)hydrazinyl]ethyl}prop-2-enamide(non-preferredname)
Smiles: COc1ccccc1/C=C\C(=O)NCC(=O)N/N=C(/Cc1ccccc1)\C
STK531409
Synonyms: 1-(2-fluorobenzyl)-3-{(E)-[2-(4-nitrophenyl)hydrazinylidene]methyl}-1H-indole
Smiles: Fc1ccccc1Cn1cc(c2c1cccc2)/C=N/Nc1ccc(cc1)[N+](=O)[O-]
STK531410
Synonyms: N-{2-[(2E)-2-(2,4-dihydroxybenzylidene)hydrazinyl]-2-oxoethyl}-3,4,5-trimethoxybenzamide(non-preferredname)
Smiles: COc1cc(cc(c1OC)OC)C(=O)NCC(=O)N/N=C/c1ccc(cc1O)O
STK531411
Synonyms: 2,2-dimethyl-8-(methylsulfanyl)-5-(propan-2-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)C(C)C
STK531412
Synonyms: 6-(propan-2-yl)-3-(prop-2-en-1-yl)-2-(prop-2-en-1-ylsulfanyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: C=CCn1c(SCC=C)nc2c(c1=O)c1CC(OCc1s2)C(C)C
STK531413
Synonyms: ethyl{[7-tert-butyl-3-(2-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccccc1C)CCC(C3)C(C)(C)C
STK531414
Synonyms: 1-(hexylsulfanyl)-4-(2-methoxyphenyl)-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CCCCCCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1OC)CCC3
STK531415
Synonyms: 2-[(4-amino-5-propyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-phenyl-N-(propan-2-yl)acetamide
Smiles: CCCc1nnc(n1N)SCC(=O)N(c1ccccc1)C(C)C
STK531416
Synonyms: N'-[(1Z)-1-(4-chlorophenyl)ethylidene]-2,2-diphenylcyclopropanecarbohydrazide
Smiles: O=C(C1CC1(c1ccccc1)c1ccccc1)N/N=C(\c1ccc(cc1)Cl)/C
STK531417
Synonyms: 2,6-dibutoxy-N-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)aniline
Smiles: CCCCOc1cccc(c1NCC1COc2c(O1)cccc2)OCCCC
STK531418
Synonyms: 3-(2-methoxyphenyl)-2-(methylsulfanyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CSc1nc2sc3c(c2c(=O)n1c1ccccc1OC)CCC3
STK531419
Synonyms: N~2~-propan-2-yl-N-tricyclo[3.3.1.1~3,7~]dec-1-ylglycinamide
Smiles: CC(NCC(=O)NC12CC3CC(C2)CC(C1)C3)C
STK531421
Synonyms: 9-(heptylsulfanyl)-8-(3-methylphenyl)-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: CCCCCCCSc1nc2sc3c(c2c(=O)n1c1cccc(c1)C)CCc1c3cccc1
STK531424
Synonyms: 2-(5-amino-1,3,4-thiadiazol-2-yl)-N'-[(E)-{3-bromo-5-methoxy-4-[2-(4-methylphenoxy)ethoxy]phenyl}methylidene]acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)Cc2nnc(s2)N)cc(c1OCCOc1ccc(cc1)C)Br
STK531425
Synonyms: N-(2-{(2Z)-2-[1-(3,4-dichlorophenyl)ethylidene]hydrazinyl}-2-oxoethyl)pyridine-3-carboxamide(non-preferredname)
Smiles: O=C(CNC(=O)c1cccnc1)N/N=C(\c1ccc(c(c1)Cl)Cl)/C
STK531426
Synonyms: 5,7-dimethyl-2-[4-(prop-2-en-1-yloxy)phenyl]-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-ol
Smiles: C=CCOc1ccc(cc1)C1N2CC3(CN1CC(C2)(C3O)C)C
STK531428
Synonyms: 1-benzyl-4-[(2E)-2-benzylidenehydrazinyl]phthalazine
Smiles: c1ccc(cc1)/C=N/Nc1nnc(c2c1cccc2)Cc1ccccc1
STK531429
Synonyms: 1-(4-bromophenyl)-2-{[2,2-dimethyl-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]sulfanyl}ethanone
Smiles: Brc1ccc(cc1)C(=O)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1
STK531430
Synonyms: 1-chloro-4-(2,4-dichlorophenyl)-6-methyl-9-nitro-2-[(2-nitrophenyl)sulfanyl]-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline
Smiles: Clc1ccc(c(c1)Cl)C1Nc2c(C)ccc(c2C2C1CC(C2Cl)Sc1ccccc1[N+](=O)[O-])[N+](=O)[O-]
STK531431
Synonyms: 3-ethyl-6-iodo-2-[(Z)-(1-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]quinazolin-4(3H)-one
Smiles: CCn1c(/C=C\2/c3ccccc3N(C2=O)C)nc2c(c1=O)cc(cc2)I
STK531432
Synonyms: 3-(3-methylphenyl)-2-(2-methylpropyl)quinazolin-4(3H)-one
Smiles: CC(Cc1nc2ccccc2c(=O)n1c1cccc(c1)C)C
STK531433
Synonyms: 2-(heptylsulfanyl)-7-methyl-3-(2-methylphenyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CCCCCCCSc1nc2sc3c(c2c(=O)n1c1ccccc1C)CCN(C3)C
STK531434
Synonyms: 2-(5-amino-1,3,4-thiadiazol-2-yl)-N'-[(E)-(1-benzyl-1H-indol-3-yl)methylidene]acetohydrazide
Smiles: O=C(Cc1nnc(s1)N)N/N=C/c1cn(c2c1cccc2)Cc1ccccc1
STK531436
Synonyms: N-butyl-N-ethyl-5-(morpholin-4-yl)-1,2,3,4-tetrahydro[1,2,3]triazino[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine
Smiles: CCCCN(c1nnnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1)CC
STK531437
Synonyms: 2-(dimethylamino)ethyl(tricyclo[3.3.1.1~3,7~]dec-1-ylmethyl)carbamate
Smiles: CN(CCOC(=O)NCC12CC3CC(C2)CC(C1)C3)C
STK531441
Synonyms: 2-(2-hydroxyphenyl)-5,7-dipropyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Smiles: CCCC12CN3CC(C2=O)(CN(C1)C3c1ccccc1O)CCC
STK531442
Synonyms: 2,5-bis[(dimethylamino)methyl]-1,6-bis(4-propoxyphenyl)hexane-1,6-dione
Smiles: CCCOc1ccc(cc1)C(=O)C(CN(C)C)CCC(C(=O)c1ccc(cc1)OCCC)CN(C)C
STK531443
Synonyms: (bis{[5-methyl-2-(propan-2-yl)cyclohexyl]oxy}phosphoryl)(4-bromophenyl)methylbenzoate
Smiles: CC1CCC(C(C1)OP(=O)(C(c1ccc(cc1)Br)OC(=O)c1ccccc1)OC1CC(C)CCC1C(C)C)C(C)C
STK531444
Synonyms: (3Z)-3-[3-(3-hydroxyphenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]-1-methyl-1,3-dihydro-2H-indol-2-one
Smiles: Oc1cccc(c1)N1C(=S)S/C(=C/2\C(=O)N(c3c2cccc3)C)/C1=O
STK531447
Synonyms: (6Z)-5-imino-6-({5-[(4-methylphenyl)sulfanyl]furan-2-yl}methylidene)-2-(propan-2-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: Cc1ccc(cc1)Sc1ccc(o1)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)C(C)C
STK531448
Synonyms: methyl3-{[2,2-dimethyl-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]sulfanyl}propanoate
Smiles: COC(=O)CCSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1
STK531449
Synonyms: 2-[(2E)-4-(4-ethoxyphenyl)-5-methyl-2-(phenylimino)-1,3-thiazol-3(2H)-yl]ethyl2-chlorobenzoate
Smiles: CCOc1ccc(cc1)c1c(C)s/c(=N/c2ccccc2)/n1CCOC(=O)c1ccccc1Cl
STK531452
Synonyms: (6E)-6-{5-chloro-2-[2-(3-ethyl-5-methylphenoxy)ethoxy]benzylidene}-5-imino-2-(trifluoromethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCc1cc(OCCOc2ccc(cc2/C=C\2/C(=O)N=c3n(C2=N)nc(s3)C(F)(F)F)Cl)cc(c1)C
STK531453
Synonyms: 3-{2-[(2Z)-2-(butan-2-ylidene)hydrazinyl]-1,3-thiazol-4-yl}-6-methoxy-2H-chromen-2-one
Smiles: CC/C(=N\Nc1scc(n1)c1cc2cc(OC)ccc2oc1=O)/C
STK531455
Synonyms: 3-benzyl-2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-8-ethyl-8-methyl-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Smiles: CCC1(C)OCc2c(C1)nc1c(c2)c(=O)n(c(n1)SCC(=O)c1ccc(cc1)Br)Cc1ccccc1
STK531456
Synonyms: 8-(octylsulfanyl)-5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: CCCCCCCCSc1ncnc2c1sc1c2c2CCCCc2c(n1)CCC
STK531459
Synonyms: 5-methyl-2-(propan-2-yl)cyclohexyl[4-(dimethylamino)phenyl][(2-fluorophenyl)(phenylamino)methyl]phosphinate
Smiles: CC1CCC(C(C1)OP(=O)(C(c1ccccc1F)Nc1ccccc1)c1ccc(cc1)N(C)C)C(C)C
STK531460
Synonyms: 9-(benzylsulfanyl)-8-(3-methylphenyl)-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: Cc1cccc(c1)n1c(SCc2ccccc2)nc2c(c1=O)c1CCc3c(c1s2)cccc3
STK531462
Synonyms: (6E)-5-imino-6-{3-methoxy-4-[2-(2-methoxyphenoxy)ethoxy]benzylidene}-2-(trifluoromethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: COc1cc(ccc1OCCOc1ccccc1OC)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)C(F)(F)F
STK531463
Synonyms: ethyl2-[({3-[(phenylsulfonyl)amino]naphthalen-2-yl}carbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2cc3ccccc3cc2NS(=O)(=O)c2ccccc2)sc2c1CCCC2
STK531464
Synonyms: N-(2-{(2Z)-2-[1-(3,4-dichlorophenyl)ethylidene]hydrazinyl}-2-oxoethyl)-2-fluorobenzamide(non-preferredname)
Smiles: O=C(CNC(=O)c1ccccc1F)N/N=C(\c1ccc(c(c1)Cl)Cl)/C
STK531465
Synonyms: N'-[(1Z)-1-(3,4-dichlorophenyl)ethylidene]-2-[2-(pyridin-2-yl)-1H-benzimidazol-1-yl]acetohydrazide
Smiles: O=C(Cn1c(nc2c1cccc2)c1ccccn1)N/N=C(\c1ccc(c(c1)Cl)Cl)/C
STK531466
Synonyms: N-(5-{2-[(2E)-2-{5-chloro-2-[(2-chlorobenzyl)oxy]benzylidene}hydrazinyl]-2-oxoethyl}-1,3,4-thiadiazol-2-yl)-4-methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)Nc1nnc(s1)CC(=O)N/N=C/c1cc(Cl)ccc1OCc1ccccc1Cl
STK531467
Synonyms: N-{2-oxo-2-[(2E)-2-(1-phenylpropan-2-ylidene)hydrazinyl]ethyl}pyridine-4-carboxamide(non-preferredname)
Smiles: O=C(CNC(=O)c1ccncc1)N/N=C(/Cc1ccccc1)\C
STK531469
Synonyms: 1-(butylsulfanyl)-4-(furan-2-ylmethyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Smiles: CCCCSc1nnc2n1c1c3ccccc3CC3(c1c(=O)n2Cc1ccco1)CCCCC3
STK531470
Synonyms: 4-chloro-6,6-dimethyl-2-phenyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Smiles: Clc1nc(nc2c1c1CC(C)(C)OCc1s2)c1ccccc1
STK531471
Synonyms: N-(3-chloropropyl)-N-[cyano(phenyl)methyl]benzamide
Smiles: ClCCCN(C(c1ccccc1)C#N)C(=O)c1ccccc1
STK531472
Synonyms: bis[5-methyl-2-(propan-2-yl)cyclohexyl]tert-butylphosphoramidate
Smiles: CC1CCC(C(C1)OP(=O)(NC(C)(C)C)OC1CC(C)CCC1C(C)C)C(C)C
STK531473
Synonyms: N-(2-{(2E)-2-[1-(2,4-dimethoxyphenyl)ethylidene]hydrazinyl}-2-oxoethyl)-3,4,5-trimethoxybenzamide(non-preferredname)
Smiles: COc1ccc(c(c1)OC)/C(=N/NC(=O)CNC(=O)c1cc(OC)c(c(c1)OC)OC)/C
STK531474
Synonyms: 5-bromo-6-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}imidazo[2,1-b][1,3]thiazole
Smiles: Brc1c(CSc2nnnn2c2ccccc2)nc2n1ccs2
STK531476
Synonyms: 2,4-dichloro-N-(2-{(2Z)-2-[1-(furan-2-yl)ethylidene]hydrazinyl}-2-oxoethyl)benzamide(non-preferredname)
Smiles: O=C(N/N=C(\c1ccco1)/C)CNC(=O)c1ccc(cc1Cl)Cl
STK531477
Synonyms: N-(1,3-thiazol-2-yl)undec-10-enamide
Smiles: C=CCCCCCCCCC(=O)Nc1nccs1
STK531479
Synonyms: 5-propyl-8-(propylsulfanyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: CCCSc1ncnc2c1sc1c2c2CCCCc2c(n1)CCC
STK531480
Synonyms: 2-[3-(4-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]-N-methylhydrazinecarbothioamide
Smiles: CNC(=S)NNc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)OC)CCCCC3
STK531481
Synonyms: 8-(bromomethyl)-2,3-dimethyl-7,8-dihydro-4H-[1,3]thiazolo[3,2-a]thieno[3,2-e]pyrimidin-4-one
Smiles: BrCC1CSc2n1c1sc(c(c1c(=O)n2)C)C
STK531482
Synonyms: N-[5-(2-{(2E)-2-[2-(benzyloxy)-5-chlorobenzylidene]hydrazinyl}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]-2-methylbenzamide
Smiles: O=C(Cc1nnc(s1)NC(=O)c1ccccc1C)N/N=C/c1cc(Cl)ccc1OCc1ccccc1
STK531483
Synonyms: N-(4-methylphenyl)-2-{[3-(4-methylphenyl)-4-oxo-7-propyl-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Smiles: CCCN1CCc2c(C1)sc1c2c(=O)n(c(n1)SCC(=O)Nc1ccc(cc1)C)c1ccc(cc1)C
STK531485
Synonyms: 2-(dec-9-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: C=CCCCCCCCCc1nc2sc3c(c2c(=O)[nH]1)CCCC3
STK531486
Synonyms: 6-ethyl-6-methyl-3-(2-methylphenyl)-2-(prop-2-en-1-ylsulfanyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: C=CCSc1nc2sc3c(c2c(=O)n1c1ccccc1C)CC(OC3)(C)CC
STK531487
Synonyms: 2-{[2,2-dimethyl-5-(propan-2-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]sulfanyl}acetamide
Smiles: NC(=O)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)C(C)C
STK531488
Synonyms: pentyl2-{[(4-chlorophenyl)carbonyl]amino}-1-cyclohexyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCCCCOC(=O)c1c(NC(=O)c2ccc(cc2)Cl)n(c2c1nc1ccccc1n2)C1CCCCC1
STK531489
Synonyms: methyl2-(4-benzylpiperazin-1-yl)-5-nitrobenzoate
Smiles: COC(=O)c1cc(ccc1N1CCN(CC1)Cc1ccccc1)[N+](=O)[O-]
STK531490
Synonyms: N-(2-{(2E)-2-[1-(2,4-dimethoxyphenyl)ethylidene]hydrazinyl}-2-oxoethyl)furan-2-carboxamide(non-preferredname)
Smiles: COc1cc(OC)ccc1/C(=N/NC(=O)CNC(=O)c1ccco1)/C
STK531491
Synonyms: methyl2-{[2,2-dimethyl-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]sulfanyl}butanoate
Smiles: CCC(C(=O)OC)Sc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1
STK531493
Synonyms: 3-methyl-2-(propan-2-ylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CC(Sc1nc2c3ccccc3CC3(c2c(=O)n1C)CCCCC3)C
STK531494
Synonyms: (5Z)-2-(4-{4-[(5Z)-5-(4-ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}piperazin-1-yl)-5-(4-methoxybenzylidene)-1,3-thiazol-4(5H)-one
Smiles: CCc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCCC(=O)N1CCN(CC1)C1=NC(=O)/C(=C/c2ccc(cc2)OC)/S1
STK531495
Synonyms: 2-(1H-benzimidazol-2-yl)-N-[(E)-(2-chlorophenyl)methylidene]aniline
Smiles: Clc1ccccc1/C=N/c1ccccc1c1nc2c([nH]1)cccc2
STK531496
Synonyms: 2-[(2-phenylethyl)sulfanyl]-6-(propan-2-yl)-3-(prop-2-en-1-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: C=CCn1c(SCCc2ccccc2)nc2c(c1=O)c1CC(OCc1s2)C(C)C
STK531498
Synonyms: 2-[(4-benzyl-5-oxo-5,7-dihydro-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclopentan]-1-yl)sulfanyl]acetamide
Smiles: NC(=O)CSc1nnc2n1c1c3ccccc3CC3(c1c(=O)n2Cc1ccccc1)CCCC3
STK531500
Synonyms: 3-ethyl-2-[(E)-2-(4-hydroxyphenyl)ethenyl]-6-iodoquinazolin-4(3H)-one
Smiles: CCn1c(/C=C/c2ccc(cc2)O)nc2c(c1=O)cc(cc2)I
STK531501
Synonyms: (6E)-5-imino-6-(2-{2-[5-methyl-2-(propan-2-yl)phenoxy]ethoxy}benzylidene)-2-(trifluoromethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: Cc1ccc(c(c1)OCCOc1ccccc1/C=C\1/C(=O)N=c2n(C1=N)nc(s2)C(F)(F)F)C(C)C
STK531502
Synonyms: 4-phenyl-1-[(2-phenylethyl)sulfanyl]-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclopentan]-5(7H)-one
Smiles: O=c1n(c2ccccc2)c2nnc(n2c2c1C1(CCCC1)Cc1c2cccc1)SCCc1ccccc1
STK531503
Synonyms: 2,2,5-trimethyl-N-(2-methylpropyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-amine
Smiles: CC(CNc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)C)C
STK531504
Synonyms: (2E)-2-[(1-{2-[5-methyl-2-(propan-2-yl)phenoxy]ethyl}-1H-indol-3-yl)methylidene]hydrazinecarbothioamide
Smiles: NC(=S)N/N=C/c1cn(c2c1cccc2)CCOc1cc(C)ccc1C(C)C
STK531505
Synonyms: 6-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-3-methylimidazo[2,1-b][1,3]thiazole
Smiles: Cc1nc(SCc2nc3n(c2)c(cs3)C)nc(c1)C
STK531506
Synonyms: N-(5-{2-[(2E)-2-{5-chloro-2-[2-(3-methoxyphenoxy)ethoxy]benzylidene}hydrazinyl]-2-oxoethyl}-1,3,4-thiadiazol-2-yl)benzamide
Smiles: COc1cccc(c1)OCCOc1ccc(cc1/C=N/NC(=O)Cc1nnc(s1)NC(=O)c1ccccc1)Cl
STK531507
Synonyms: N-[(1E)-3-amino-3-oxo-1-phenylprop-1-en-2-yl]-2-bromobenzamide
Smiles: NC(=O)/C(=C\c1ccccc1)/NC(=O)c1ccccc1Br
STK531508
Synonyms: 1-[4-(diphenylmethyl)piperazin-1-yl]-3-methyl-2-octylpyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCCCCCCCc1c(C)c(C#N)c2n(c1N1CCN(CC1)C(c1ccccc1)c1ccccc1)c1ccccc1n2
STK531509
Synonyms: N-(5-{2-[(2E)-2-{4-[(2,4-dichlorobenzyl)oxy]-3-methoxybenzylidene}hydrazinyl]-2-oxoethyl}-1,3,4-thiadiazol-2-yl)benzamide
Smiles: COc1cc(/C=N/NC(=O)Cc2nnc(s2)NC(=O)c2ccccc2)ccc1OCc1ccc(cc1Cl)Cl
STK531510
Synonyms: 8-ethyl-3,3-dimethyl-6-[(2-phenylethyl)amino]-3,4-dihydro-1H-pyrano[3,4-c]pyridine-5-carbonitrile
Smiles: N#Cc1c(NCCc2ccccc2)nc(c2c1CC(C)(C)OC2)CC
STK531511
Synonyms: 2,6-dichloro-N'-[(E)-(3,4-dimethoxyphenyl)methylidene]-4-methylbenzenesulfonohydrazide
Smiles: COc1cc(/C=N/NS(=O)(=O)c2c(Cl)cc(cc2Cl)C)ccc1OC
STK531513
Synonyms: ethyl{[4-amino-6-(propan-2-yl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nc(N)c2c(n1)sc1c2CC(OC1)C(C)C
STK531514
Synonyms: N'-[(4-chlorophenyl)carbonyl]-8-methoxy-2-oxo-2H-chromene-3-carbohydrazide
Smiles: COc1cccc2c1oc(=O)c(c2)C(=O)NNC(=O)c1ccc(cc1)Cl
STK531516
Synonyms: 2-[(2E)-2-(4-bromobenzylidene)hydrazinyl]-3-(3-methoxyphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: COc1cccc(c1)n1c(N/N=C/c2ccc(cc2)Br)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
STK531517
Synonyms: 2-({2-ethoxy-4-[(Z)-(2-ethyl-5-imino-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl]phenoxy}methyl)benzonitrile
Smiles: CCOc1cc(ccc1OCc1ccccc1C#N)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)CC
STK531518
Synonyms: (6E)-5-imino-6-{2-[2-(2-methoxyphenoxy)ethoxy]-5-nitrobenzylidene}-2-(trifluoromethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: COc1ccccc1OCCOc1ccc(cc1/C=C\1/C(=O)N=c2n(C1=N)nc(s2)C(F)(F)F)[N+](=O)[O-]
STK531519
Synonyms: 4-(2-methoxyphenyl)-1-[(3-methylbutyl)sulfanyl]-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: COc1ccccc1n1c(=O)c2c3CCCc3sc2n2c1nnc2SCCC(C)C
STK531520
Synonyms: 2-(hexylsulfanyl)-3-methyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CCCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1C)CCCCC3
STK531521
Synonyms: 2,2-dimethyl-5-(morpholin-4-yl)-8-(propylsulfanyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CCCSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1
STK531522
Synonyms: (6Z)-6-{4-[2-(4-tert-butylphenoxy)ethoxy]benzylidene}-5-imino-2-propyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCCc1nn2c(=NC(=O)/C(=C\c3ccc(cc3)OCCOc3ccc(cc3)C(C)(C)C)/C2=N)s1
STK531523
Synonyms: 2-[(3-bromobenzyl)sulfanyl]-3-(4-methylphenyl)quinazolin-4(3H)-one
Smiles: Cc1ccc(cc1)n1c(SCc2cccc(c2)Br)nc2c(c1=O)cccc2
STK531526
Synonyms: 3-(2-methylphenyl)-2-(methylsulfanyl)-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one
Smiles: CSc1nc2nc3CCCCc3cc2c(=O)n1c1ccccc1C
STK531527
Synonyms: 2-(methylsulfanyl)-6-(propan-2-yl)-3-(prop-2-en-1-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: C=CCn1c(SC)nc2c(c1=O)c1CC(OCc1s2)C(C)C
STK531528
Synonyms: 2-[(Z)-(1,5-dimethyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-6-iodo-3-(2-methylphenyl)quinazolin-4(3H)-one
Smiles: Ic1ccc2c(c1)c(=O)n(c(n2)/C=C\1/c2cc(C)ccc2N(C1=O)C)c1ccccc1C
STK531529
Synonyms: 1-amino-8,8-dimethyl-5-(morpholin-4-yl)-N-phenyl-8,9-dihydro-6H-pyrano[4,3-d]thieno[2,3-b]pyridine-2-carboxamide
Smiles: O=C(c1sc2c(c1N)c1CC(C)(C)OCc1c(n2)N1CCOCC1)Nc1ccccc1
STK531530
Synonyms: (2E)-3-(2-methoxyphenyl)-N-(2-{(2E)-2-[(2-methyl-1H-indol-3-yl)methylidene]hydrazinyl}-2-oxoethyl)prop-2-enamide(non-preferredname)
Smiles: COc1ccccc1/C=C/C(=O)NCC(=O)N/N=C/c1c(C)[nH]c2c1cccc2
STK531531
Synonyms: N-[(2Z)-2-{[(2-bromophenyl)carbonyl]amino}-3-phenylprop-2-enoyl]-beta-alanine
Smiles: OC(=O)CCNC(=O)/C(=C/c1ccccc1)/NC(=O)c1ccccc1Br
STK531532
Synonyms: 2-(1H-benzimidazol-2-yl)-N-[(E)-(4-chlorophenyl)methylidene]aniline
Smiles: Clc1ccc(cc1)/C=N/c1ccccc1c1nc2c([nH]1)cccc2
STK531534
Synonyms: N-(2-{(2E)-2-[1-(2,4-dimethoxyphenyl)ethylidene]hydrazinyl}-2-oxoethyl)-2-phenoxyacetamide(non-preferredname)
Smiles: COc1cc(OC)ccc1/C(=N/NC(=O)CNC(=O)COc1ccccc1)/C
STK531535
Synonyms: 2-(hexylsulfanyl)-3-(4-methylphenyl)-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCCCCCSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CC(OC3)C(C)C
STK531536
Synonyms: 2-(cyclopentylsulfanyl)-3-ethyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CCn1c(SC2CCCC2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
STK531537
Synonyms: 1,1'-{sulfonylbis[(2,6-dibromobenzene-4,1-diyl)oxy]}bis[3-(diethylamino)propan-2-ol]
Smiles: CCN(CC(COc1c(Br)cc(cc1Br)S(=O)(=O)c1cc(Br)c(c(c1)Br)OCC(CN(CC)CC)O)O)CC
STK531538
Synonyms: 3-(4-methoxyphenyl)-7-methyl-2-(propylsulfanyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CCCSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)OC)CCN(C3)C
STK531539
Synonyms: dipropan-2-yl[phenyl(phenylamino)methyl]phosphonate
Smiles: CC(OP(=O)(C(c1ccccc1)Nc1ccccc1)OC(C)C)C
STK531540
Synonyms: N-{2-[(2E)-2-(2,4-dihydroxybenzylidene)hydrazinyl]-2-oxoethyl}-4-fluorobenzamide(non-preferredname)
Smiles: O=C(CNC(=O)c1ccc(cc1)F)N/N=C/c1ccc(cc1O)O
STK531541
Synonyms: 2-{[(5-bromoimidazo[2,1-b][1,3]thiazol-6-yl)methyl]sulfanyl}-1,3-benzothiazole
Smiles: Brc1c(CSc2nc3c(s2)cccc3)nc2n1ccs2
STK531542
Synonyms: N-(2-{(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl}-2-oxoethyl)-2-phenoxyacetamide(non-preferredname)
Smiles: O=C(N/N=C(\c1ccc(cc1)Cl)/C)CNC(=O)COc1ccccc1
STK531543
Synonyms: 6,6-dimethyl-3-(2-methylphenyl)-2-[(naphthalen-1-ylmethyl)sulfanyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: O=c1n(c(SCc2cccc3c2cccc3)nc2c1c1CC(C)(C)OCc1s2)c1ccccc1C
STK531544
Synonyms: N-benzyl-2-[3-(2-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]hydrazinecarbothioamide
Smiles: S=C(NNc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCCC3)NCc1ccccc1
STK531545
Synonyms: 9-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-8-(3-methylphenyl)-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: Cc1cccc(c1)n1c(SCC(=O)c2ccc(cc2)Cl)nc2c(c1=O)c1CCc3c(c1s2)cccc3
STK531546
Synonyms: 2-[4-(prop-2-en-1-yloxy)phenyl]-1,3-thiazolidine-4-carboxylicacid
Smiles: C=CCOc1ccc(cc1)C1SCC(N1)C(=O)O
STK531547
Synonyms: 5-(furan-2-yl)-2,2-dimethyl-N-(2-phenylethyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-amine
Smiles: CC1(C)OCc2c(C1)c1c(nc2c2ccco2)sc2c1ncnc2NCCc1ccccc1
STK531551
Synonyms: N,N-dibutyl-2,2-dimethyl-5-(2-methylpropyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-amine
Smiles: CCCCN(c1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)CC(C)C)CCCC
STK531552
Synonyms: 6,8-dibromo-3-{[2-(4-nitrophenyl)-1,3-thiazolidin-3-yl]carbonyl}-2H-chromen-2-one
Smiles: Brc1cc(Br)c2c(c1)cc(c(=O)o2)C(=O)N1CCSC1c1ccc(cc1)[N+](=O)[O-]
STK531553
Synonyms: 2-(5-amino-1,3,4-thiadiazol-2-yl)-N'-[(E)-(1-{2-[4-(hexyloxy)phenoxy]ethyl}-1H-indol-3-yl)methylidene]acetohydrazide
Smiles: CCCCCCOc1ccc(cc1)OCCn1cc(c2c1cccc2)/C=N/NC(=O)Cc1nnc(s1)N
STK531555
Synonyms: 1-(furan-2-ylmethyl)-2-imino-8-methyl-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile
Smiles: N#Cc1cc2c(=O)n3cc(C)ccc3nc2n(c1=N)Cc1ccco1
STK531556
Synonyms: (6E)-6-{2-[(4-fluorobenzyl)oxy]benzylidene}-5-imino-2-(trifluoromethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: Fc1ccc(cc1)COc1ccccc1/C=C\1/C(=O)N=c2n(C1=N)nc(s2)C(F)(F)F
STK531557
Synonyms: cyclopentane-1,1-diyldibenzene-4,1-diylbis(3-nitrobenzoate)
Smiles: O=C(c1cccc(c1)[N+](=O)[O-])Oc1ccc(cc1)C1(CCCC1)c1ccc(cc1)OC(=O)c1cccc(c1)[N+](=O)[O-]
STK531558
Synonyms: dipropan-2-yl[(4-bromophenyl)(hydroxy)methyl]phosphonate
Smiles: OC(P(=O)(OC(C)C)OC(C)C)c1ccc(cc1)Br
STK531560
Synonyms: 1-phenyl-5-(prop-2-en-1-yl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Smiles: C=CCn1cnc2c(c1=O)cnn2c1ccccc1
STK531562
Synonyms: N-benzyl-2-[3-(4-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]hydrazinecarbothioamide
Smiles: COc1ccc(cc1)n1c(NNC(=S)NCc2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
STK531563
Synonyms: N-(2-{(2E)-2-[2-(benzyloxy)-5-bromobenzylidene]hydrazinyl}-2-oxoethyl)-4-fluorobenzamide(non-preferredname)
Smiles: O=C(CNC(=O)c1ccc(cc1)F)N/N=C/c1cc(Br)ccc1OCc1ccccc1
STK531564
Synonyms: N-[5-(2-{(2E)-2-[2-(benzyloxy)-3,5-dichlorobenzylidene]hydrazinyl}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]benzamide
Smiles: O=C(Cc1nnc(s1)NC(=O)c1ccccc1)N/N=C/c1cc(Cl)cc(c1OCc1ccccc1)Cl
STK531565
Synonyms: 4-(2-methoxyphenyl)-1-(propan-2-ylsulfanyl)-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: COc1ccccc1n1c2nnc(n2c2c(c1=O)c1CCCc1s2)SC(C)C
STK531567
Synonyms: 2,2'-(11,12,13,14-tetrahydro-10H-cyclohepta[4,5]thieno[3,2-e]bis[1,2,4]triazolo[4,3-a:4',3'-c]pyrimidine-3,7-diyldisulfanediyl)bis[1-(4-chlorophenyl)ethanone]
Smiles: Clc1ccc(cc1)C(=O)CSc1nnc2n1c1sc3c(c1c1n2c(SCC(=O)c2ccc(cc2)Cl)nn1)CCCCC3
STK531568
Synonyms: dibutyl[hydroxy(4-methoxyphenyl)methyl]phosphonate
Smiles: CCCCOP(=O)(C(c1ccc(cc1)OC)O)OCCCC
STK531569
Synonyms: 2-{[5-(morpholin-4-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]sulfanyl}-1-phenylethanone
Smiles: O=C(c1ccccc1)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1
STK531570
Synonyms: 3-bromo-5-chloro-N-[4-chloro-3-(phenylcarbonyl)phenyl]-2-hydroxybenzamide
Smiles: Clc1cc(Br)c(c(c1)C(=O)Nc1ccc(c(c1)C(=O)c1ccccc1)Cl)O
STK531571
Synonyms: 3-(4-methoxyphenyl)-2-[(3-{[3-(2-methylprop-2-en-1-yl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}propyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H
Smiles: COc1ccc(cc1)n1c(SCCCSc2nc3c4ccccc4CC4(c3c(=O)n2CC(=C)C)CCCCC4)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
STK531572
Synonyms: N-{[2-(4-oxo-3-phenyl-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)hydrazinyl]carbonothioyl}benzamide
Smiles: S=C(NC(=O)c1ccccc1)NNc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1)CCCC3
STK531574
Synonyms: 3-amino-2-(3-phenylpropyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: O=c1n(N)c(CCCc2ccccc2)nc2c1c1CCCc1s2
STK531576
Synonyms: 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-phenyl-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: Brc1ccc(cc1)C(=O)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CCCCC3
STK531578
Synonyms: 2-[(2-ethoxy-4-{(E)-[5-imino-7-oxo-2-(trifluoromethyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene]methyl}phenoxy)methyl]benzonitrile
Smiles: CCOc1cc(ccc1OCc1ccccc1C#N)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)C(F)(F)F
STK531579
Synonyms: 2,2-dimethyl-8-(2-methylpropoxy)-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CC(COc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1)C
STK531580
Synonyms: 5-(morpholin-4-yl)-8-(piperazin-1-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: N1CCN(CC1)c1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1
STK531581
Synonyms: 2-(propan-2-yl)-4-(triphenylphosphonio)-1,3-oxazole-5-thiolate
Smiles: [S-]c1oc(nc1[P+](c1ccccc1)(c1ccccc1)c1ccccc1)C(C)C
STK531582
Synonyms: 3-(4-methoxyphenyl)-7-methyl-2-(methylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)OC)CCC(C3)C
STK531583
Synonyms: N-{[2-(dimethylamino)ethyl]carbamothioyl}tricyclo[3.3.1.1~3,7~]decane-1-carboxamide
Smiles: CN(CCNC(=S)NC(=O)C12CC3CC(C2)CC(C1)C3)C
STK531584
Synonyms: 2-[(2E)-2-(4-methoxybenzylidene)hydrazinyl]-3-phenyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: COc1ccc(cc1)/C=N/Nc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1)CCCC3
STK531585
Synonyms: 2,2-dimethyl-5-(morpholin-4-yl)-8-[(2-phenoxyethyl)sulfanyl]-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CC1(C)OCc2c(C1)c1c(nc2N2CCOCC2)sc2c1ncnc2SCCOc1ccccc1
STK531586
Synonyms: N'-acetyl-2-[(5Z)-5-benzylidene-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetohydrazide
Smiles: O=C(CN1C(=S)S/C(=C\c2ccccc2)/C1=O)NNC(=O)C
STK531587
Synonyms: 2-{[2,2-dimethyl-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]sulfanyl}-1-(piperidin-1-yl)ethanone
Smiles: O=C(N1CCCCC1)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1
STK531588
Synonyms: N-(3'-cyano-1'H-spiro[cyclohexane-1,2'-naphthalen]-4'-yl)-2-{[3-(4-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)NC2=C(C#N)C3(Cc4c2cccc4)CCCCC3)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
STK531589
Synonyms: 2-{[(E)-(3,4,5-trichlorothiophen-2-yl)methylidene]amino}ethanol
Smiles: OCC/N=C/c1sc(c(c1Cl)Cl)Cl
STK531590
Synonyms: N-(4-methoxyphenyl)-2-[3-(4-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]hydrazinecarbothioamide
Smiles: COc1ccc(cc1)NC(=S)NNc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)OC)CCCCC3
STK531591
Synonyms: (6Z)-5-imino-6-(2-methoxybenzylidene)-2-(propan-2-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: COc1ccccc1/C=C/1\C(=O)N=c2n(C1=N)nc(s2)C(C)C
STK531592
Synonyms: 7-ethyl-1-(heptylsulfanyl)-4,7-dimethyl-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CCCCCCCSc1nnc2n1c1sc3c(c1c(=O)n2C)CC(OC3)(C)CC
STK531593
Synonyms: N-[(1Z)-3-amino-1-(1,3-benzodioxol-5-yl)-3-oxoprop-1-en-2-yl]-2-methoxybenzamide
Smiles: COc1ccccc1C(=O)N/C(=C\c1ccc2c(c1)OCO2)/C(=O)N
STK531594
Synonyms: 2-(benzylsulfanyl)-3-(3-bromophenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: Brc1cccc(c1)n1c(SCc2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
STK531595
Synonyms: 2,4-dihydrazinyl-5-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Smiles: NNc1nc(NN)nc2c1c1C(C)CCCc1s2
STK531596
Synonyms: 8-(butylsulfanyl)-5-methyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: CCCCSc1ncnc2c1sc1c2c2CCCCc2c(n1)C
STK531597
Synonyms: 6-iodo-3-(3-methoxyphenyl)-2-[(E)-2-(2-methyl-1H-indol-3-yl)ethenyl]quinazolin-4(3H)-one
Smiles: COc1cccc(c1)n1c(/C=C/c2c(C)[nH]c3c2cccc3)nc2c(c1=O)cc(cc2)I
STK531599
Synonyms: 1-[(4-bromobenzyl)sulfanyl]-4-(furan-2-ylmethyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Smiles: Brc1ccc(cc1)CSc1nnc2n1c1c3ccccc3CC3(c1c(=O)n2Cc1ccco1)CCCCC3
STK531600
Synonyms: 6-methyl-4-(4-methylphenyl)-1-(prop-2-en-1-ylsulfanyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: C=CCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)C)C(C)CCC3
STK531601
Synonyms: 8-butoxy-2,2-dimethyl-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazine
Smiles: CCCCOc1nnnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1
STK531602
Synonyms: 1-phenyl-2-[(5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl)sulfanyl]ethanone
Smiles: CCCc1nc2sc3c(c2c2c1CCCC2)ncnc3SCC(=O)c1ccccc1
STK531603
Synonyms: 4-(5-{(E)-[2-(4-nitrophenyl)hydrazinylidene]methyl}furan-2-yl)benzoicacid
Smiles: OC(=O)c1ccc(cc1)c1ccc(o1)/C=N/Nc1ccc(cc1)[N+](=O)[O-]
STK531604
Synonyms: (6Z)-2-ethyl-6-{4-[(4-fluorobenzyl)oxy]-3-methoxybenzylidene}-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: COc1cc(ccc1OCc1ccc(cc1)F)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)CC
STK531605
Synonyms: 2-benzyl-3-methyl-1-(4-methylpiperazin-1-yl)pyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: N#Cc1c(C)c(Cc2ccccc2)c(n2c1nc1c2cccc1)N1CCN(CC1)C
STK531606
Synonyms: 2-[(naphthalen-1-ylmethyl)sulfanyl]-3-phenyl-7-(2-phenylethyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: O=c1n(c2ccccc2)c(SCc2cccc3c2cccc3)nc2c1c1CCN(Cc1s2)CCc1ccccc1
STK531608
Synonyms: 3-[2-(4-bromophenyl)-2-oxoethyl]-8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: Brc1ccc(cc1)C(=O)Cn1cnc2c(c1=O)sc1c2cc2c(n1)CC(OC2)(C)C
STK531609
Synonyms: N-benzyl-5-(furan-2-yl)-2,2-dimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-amine
Smiles: CC1(C)OCc2c(C1)c1c(nc2c2ccco2)sc2c1ncnc2NCc1ccccc1
STK531610
Synonyms: 3-(2-methylphenyl)-2-{[(4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)methyl]sulfanyl}-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: Cc1ccccc1n1c(SCc2[nH]c(=O)c3c(n2)c2ccccc2CC23CCCCC2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
STK531611
Synonyms: 7-(2,4-dinitrophenoxy)-2H-chromen-2-one
Smiles: O=c1ccc2c(o1)cc(cc2)Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
STK531612
Synonyms: 2-[(2,4-dimethylbenzyl)sulfanyl]-3-(furan-2-ylmethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: Cc1ccc(c(c1)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCCC3
STK531613
Synonyms: bis(2-methylpropyl)[phenyl(phenylamino)methyl]phosphonate
Smiles: CC(COP(=O)(C(c1ccccc1)Nc1ccccc1)OCC(C)C)C
STK531614
Synonyms: 1-(benzylsulfanyl)-4-(furan-2-ylmethyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Smiles: O=c1n(Cc2ccco2)c2nnc(n2c2c1C1(CCCCC1)Cc1c2cccc1)SCc1ccccc1
STK531615
Synonyms: N,N-dimethyl-N'-(2,2,5-trimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl)ethane-1,2-diamine
Smiles: CN(CCNc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)C)C
STK531616
Synonyms: 2-[(7,7-dimethyl-5-oxo-4-phenyl-4,5,6,9-tetrahydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)sulfanyl]-N-phenylacetamide
Smiles: O=C(Nc1ccccc1)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CC(OC3)(C)C
STK531617
Synonyms: 6-chloro-N-methyl-5-[4-(2-methylpropoxy)benzyl]-2-(methylsulfanyl)pyrimidin-4-amine
Smiles: CSc1nc(Cl)c(c(n1)NC)Cc1ccc(cc1)OCC(C)C
STK531618
Synonyms: 3-(3-bromophenyl)-2-(pentylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)Br)CCCCC3
STK531621
Synonyms: S-(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-yl)(2-nitrophenyl)ethanethioate
Smiles: O=C(Sc1ncnc2c1c1CCCCc1s2)Cc1ccccc1[N+](=O)[O-]
STK531622
Synonyms: ethyl2-{[(5-bromo-2-{[(4-chlorophenyl)sulfonyl]amino}phenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2cc(Br)ccc2NS(=O)(=O)c2ccc(cc2)Cl)sc2c1CCCC2
STK531625
Synonyms: bis[5-methyl-2-(propan-2-yl)cyclohexyl]{1-[4-(dimethylamino)phenyl]-2-nitroethyl}phosphonate
Smiles: CC1CCC(C(C1)OP(=O)(C(c1ccc(cc1)N(C)C)C[N+](=O)[O-])OC1CC(C)CCC1C(C)C)C(C)C
STK531626
Synonyms: 3-(4-bromophenoxy)-7-(2,4-dinitrophenoxy)-4H-chromen-4-one
Smiles: Brc1ccc(cc1)Oc1coc2c(c1=O)ccc(c2)Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
STK531627
Synonyms: (2Z)-3-[1-(4-fluorobenzyl)-1H-indol-3-yl]-2-(4-nitrophenyl)prop-2-enenitrile
Smiles: N#C/C(=C\c1cn(c2c1cccc2)Cc1ccc(cc1)F)/c1ccc(cc1)[N+](=O)[O-]
STK531628
Synonyms: 3-(3-{(E)-2-[3-(3-nitrophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]ethenyl}-1H-indol-1-yl)propanenitrile
Smiles: N#CCCn1cc(c2c1cccc2)/C=C/c1nc2ccccc2c(=O)n1c1cccc(c1)[N+](=O)[O-]
STK531629
Synonyms: N'-[(4-chlorophenyl)carbonyl]-6-methoxy-2-oxo-2H-chromene-3-carbohydrazide
Smiles: COc1ccc2c(c1)cc(c(=O)o2)C(=O)NNC(=O)c1ccc(cc1)Cl
STK531630
Synonyms: 2-methoxy-4-[(E)-{2-[(5-{[(2-methylphenyl)carbonyl]amino}-1,3,4-thiadiazol-2-yl)acetyl]hydrazinylidene}methyl]phenylbenzenesulfonate
Smiles: COc1cc(/C=N/NC(=O)Cc2nnc(s2)NC(=O)c2ccccc2C)ccc1OS(=O)(=O)c1ccccc1
STK531631
Synonyms: 2-benzyl-3-methyl-1-(octadecylamino)pyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCCCCCCCCCCCCCCCCCNc1c(Cc2ccccc2)c(C)c(c2n1c1ccccc1n2)C#N
STK531633
Synonyms: 8-[(2-phenylethyl)sulfanyl]-5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: CCCc1nc2sc3c(c2c2c1CCCC2)ncnc3SCCc1ccccc1
STK531636
Synonyms: 2-(ethylsulfanyl)-3-(4-methoxyphenyl)-7-methyl-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CCSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)OC)CCN(C3)C
STK531637
Synonyms: N'-[(3E)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-1H-indole-3-carbohydrazide
Smiles: O=C1Nc2c(/C/1=N\NC(=O)c1c[nH]c3c1cccc3)cccc2
STK531638
Synonyms: N-(2-{(2Z)-2-[1-(furan-2-yl)ethylidene]hydrazinyl}-2-oxoethyl)-2-(3-methylphenoxy)acetamide(non-preferredname)
Smiles: O=C(COc1cccc(c1)C)NCC(=O)N/N=C(\c1ccco1)/C
STK531639
Synonyms: 6-iodo-3-(4-methoxyphenyl)-2-[(E)-(5-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)n1c(/C=C\2/C(=O)Nc3c2cc(C)cc3)nc2c(c1=O)cc(cc2)I
STK531640
Synonyms: 1-(heptylsulfanyl)-4-(2-methoxyphenyl)-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CCCCCCCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1OC)CCC3
STK531642
Synonyms: 3-(3-bromophenyl)-2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: Brc1cccc(c1)n1c(SCC(=O)c2ccc(cc2)Br)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
STK531643
Synonyms: N-({2-[3-(4-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]hydrazinyl}carbonothioyl)benzamide
Smiles: COc1ccc(cc1)n1c(NNC(=S)NC(=O)c2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
STK531644
Synonyms: 8-(butylsulfanyl)-5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: CCCCSc1ncnc2c1sc1c2c2CCCCc2c(n1)CCC
STK531645
Synonyms: 3-methyl-2-octyl-1-(pyrrolidin-1-yl)pyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCCCCCCCc1c(C)c(C#N)c2n(c1N1CCCC1)c1ccccc1n2
STK531646
Synonyms: 4-[(2E)-2-{1-[4-(propan-2-yloxy)phenyl]ethylidene}hydrazinyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Smiles: CC(Oc1ccc(cc1)/C(=N/Nc1ncnc2c1c1CCCCc1s2)/C)C
STK531648
Synonyms: 6,8-dibromo-N-[3-(imidazo[1,2-a]pyridin-2-yl)phenyl]-2-oxo-2H-chromene-3-carboxamide
Smiles: Brc1cc(Br)c2c(c1)cc(c(=O)o2)C(=O)Nc1cccc(c1)c1nc2n(c1)cccc2
STK531649
Synonyms: 6,6-dimethyl-3-(2-methylphenyl)-2-(octylsulfanyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCCCCCCCSc1nc2sc3c(c2c(=O)n1c1ccccc1C)CC(OC3)(C)C
STK531650
Synonyms: 2-[(5E)-5-(1-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoicacid
Smiles: OC(=O)C(N1C(=S)S/C(=C/2\c3ccccc3N(C2=O)C)/C1=O)C
STK531651
Synonyms: 3-bromo-N-{2-oxo-2-[(2E)-2-(1-phenylpropan-2-ylidene)hydrazinyl]ethyl}benzamide(non-preferredname)
Smiles: O=C(CNC(=O)c1cccc(c1)Br)N/N=C(/Cc1ccccc1)\C
STK531652
Synonyms: (6Z)-6-[4-(benzyloxy)-3-chloro-5-methoxybenzylidene]-5-imino-2-propyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCCc1sc2=NC(=O)/C(=C\c3cc(Cl)c(c(c3)OC)OCc3ccccc3)/C(=N)n2n1
STK531653
Synonyms: bis(2-methylpropyl){[4-(dimethylamino)phenyl](hydroxy)methyl}phosphonate
Smiles: CC(COP(=O)(C(c1ccc(cc1)N(C)C)O)OCC(C)C)C
STK531654
Synonyms: (2-{[2-(diphenylphosphoryl)benzyl]oxy}benzyl)(diphenyl)phosphaneoxide
Smiles: O=P(c1ccccc1)(c1ccccc1)Cc1ccccc1OCc1ccccc1P(=O)(c1ccccc1)c1ccccc1
STK531655
Synonyms: (6E)-6-{2-[2-(4-cyclohexylphenoxy)ethoxy]benzylidene}-5-imino-2-(trifluoromethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: O=C1N=c2sc(nn2C(=N)/C/1=C\c1ccccc1OCCOc1ccc(cc1)C1CCCCC1)C(F)(F)F
STK531656
Synonyms: 4-methoxy-N-{(1Z)-3-{[3-(morpholin-4-yl)propyl]amino}-1-[5-(3-nitrophenyl)furan-2-yl]-3-oxoprop-1-en-2-yl}benzamide
Smiles: COc1ccc(cc1)C(=O)N/C(=C\c1ccc(o1)c1cccc(c1)[N+](=O)[O-])/C(=O)NCCCN1CCOCC1
STK531659
Synonyms: 5-methyl-2-(propan-2-yl)cyclohexyl[(4-bromophenyl)(phenylamino)methyl][4-(dimethylamino)phenyl]phosphinate
Smiles: CC1CCC(C(C1)OP(=O)(C(c1ccc(cc1)Br)Nc1ccccc1)c1ccc(cc1)N(C)C)C(C)C
STK531660
Synonyms: 3-phenyl-2-[(2E)-2-(pyridin-4-ylmethylidene)hydrazinyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: O=c1n(c2ccccc2)c(N/N=C/c2ccncc2)nc2c1C1(CCCC1)Cc1c2cccc1
STK531661
Synonyms: 3-(4-methoxyphenyl)-8,8-dimethyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2ccccc2)nc2c(c1=O)cc1c(n2)CC(OC1)(C)C
STK531662
Synonyms: 4-(2-methylphenyl)-1-(prop-2-en-1-ylsulfanyl)-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: C=CCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1C)CCC3
STK531663
Synonyms: N-(5-{2-[(2E)-2-{4-[(2,4-dichlorobenzyl)oxy]benzylidene}hydrazinyl]-2-oxoethyl}-1,3,4-thiadiazol-2-yl)-4-methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)Nc1nnc(s1)CC(=O)N/N=C/c1ccc(cc1)OCc1ccc(cc1Cl)Cl
STK531664
Synonyms: 5-(morpholin-4-yl)-N-(tetrahydrofuran-2-ylmethyl)-1,2,3,4-tetrahydro[1,2,3]triazino[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine
Smiles: O1CCN(CC1)c1nc2sc3c(c2c2c1CCCC2)nnnc3NCC1CCCO1
STK531665
Synonyms: 1-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-4,8-dimethyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CC1CCc2c(C1)sc1c2c(=O)n(c2n1c(SCC(=O)c1ccc(cc1)Cl)nn2)C
STK531666
Synonyms: methyl2-{[8-tert-butyl-4-(2-methylphenyl)-5-oxo-4,5,6,7,8,9-hexahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl]sulfanyl}propanoate
Smiles: COC(=O)C(Sc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1C)CCC(C3)C(C)(C)C)C
STK531667
Synonyms: 2,2'-(propane-1,3-diyldisulfanediyl)bis[3-(4-methoxyphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one]
Smiles: COc1ccc(cc1)n1c(SCCCSc2nc3c4ccccc4CC4(c3c(=O)n2c2ccc(cc2)OC)CCCCC4)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
STK531668
Synonyms: 3-(2-methylphenyl)-2-[(2-oxo-2-phenylethyl)sulfanyl]quinazolin-4(3H)-one
Smiles: O=C(c1ccccc1)CSc1nc2ccccc2c(=O)n1c1ccccc1C
STK531670
Synonyms: N-{2-[(2E)-2-(2,4-dihydroxybenzylidene)hydrazinyl]-2-oxoethyl}-1,3-benzodioxole-5-carboxamide(non-preferredname)
Smiles: O=C(CNC(=O)c1ccc2c(c1)OCO2)N/N=C/c1ccc(cc1O)O
STK531672
Synonyms: {4-(4-bromophenyl)-1-chloro-2-[(2-nitrophenyl)sulfanyl]-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinolin-6-yl}(morpholin-4-yl)methanone
Smiles: ClC1C(CC2C1c1cccc(c1NC2c1ccc(cc1)Br)C(=O)N1CCOCC1)Sc1ccccc1[N+](=O)[O-]
STK531673
Synonyms: methyl2-[(4-chlorobutanoyl)amino]-5-(propan-2-yl)-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate
Smiles: ClCCCC(=O)Nc1sc2c(c1C(=O)OC)CC(OC2)C(C)C
STK531675
Synonyms: 8-(4-methylphenyl)-9-[(2-oxo-2-phenylethyl)sulfanyl]-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: Cc1ccc(cc1)n1c(SCC(=O)c2ccccc2)nc2c(c1=O)c1CCc3c(c1s2)cccc3
STK531676
Synonyms: 4-(2-methylphenyl)-1-(methylsulfanyl)-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1C)CCC3
STK531677
Synonyms: ethyl[(3-benzyl-8-ethyl-8-methyl-4-oxo-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-2-yl)sulfanyl]acetate
Smiles: CCOC(=O)CSc1nc2nc3CC(C)(CC)OCc3cc2c(=O)n1Cc1ccccc1
STK531681
Synonyms: (6E)-5-imino-6-[(2-methyl-1-{2-[2-(prop-2-en-1-yl)phenoxy]ethyl}-1H-indol-3-yl)methylidene]-2-(trifluoromethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: C=CCc1ccccc1OCCn1c2ccccc2c(c1C)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)C(F)(F)F
STK531684
Synonyms: N-{3-chloro-4-[(4-chloronaphthalen-1-yl)oxy]phenyl}-2-hydroxy-3,5-diiodobenzamide
Smiles: Ic1cc(I)c(c(c1)C(=O)Nc1ccc(c(c1)Cl)Oc1ccc(c2c1cccc2)Cl)O
STK531685
Synonyms: 1-(cyclohexylamino)-3-methyl-2-octylpyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCCCCCCCc1c(C)c(C#N)c2n(c1NC1CCCCC1)c1ccccc1n2
STK531686
Synonyms: 3-ethyl-6-(3-nitrophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Smiles: CCc1nnc2n1N=C(CS2)c1cccc(c1)[N+](=O)[O-]
STK531687
Synonyms: 5-methyl-2-[(3-methylbutyl)sulfanyl]-3-(4-methylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CC(CCSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)C(C)CCC3)C
STK531688
Synonyms: 2-(3-benzyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)-N-(prop-2-en-1-yl)hydrazinecarbothioamide
Smiles: C=CCNC(=S)NNc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCCC3
STK531689
Synonyms: 4-{(2Z)-2-[1-(4-ethoxyphenyl)-2-phenylethylidene]hydrazinyl}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Smiles: CCOc1ccc(cc1)/C(=N\Nc1ncnc2c1c1CCCCc1s2)/Cc1ccccc1
STK531690
Synonyms: 4-(2-methylphenyl)-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: Cc1ccccc1n1c(=O)c2c3CCCc3sc2n2c1nnc2
STK531691
Synonyms: N-(2-methylprop-2-en-1-yl)-2-(4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-2-yl)hydrazinecarbothioamide
Smiles: CC(=C)CNC(=S)NNc1nc2c3ccccc3CC3(c2c(=O)[nH]1)CCCC3
STK531692
Synonyms: N-[(2Z)-2-{[(4-bromophenyl)carbonyl]amino}-3-phenylprop-2-enoyl]valine
Smiles: CC(C(C(=O)O)NC(=O)/C(=C/c1ccccc1)/NC(=O)c1ccc(cc1)Br)C
STK531693
Synonyms: N'-(diphenylmethylidene)-1H-indole-7-carbohydrazide
Smiles: O=C(c1cccc2c1[nH]cc2)N/N=C(\c1ccccc1)/c1ccccc1
STK531694
Synonyms: (5E)-5-(3-bromobenzylidene)-2-[(3,4-dimethylphenyl)amino]-1,3-thiazol-4(5H)-one
Smiles: Brc1cccc(c1)/C=C\1/SC(=NC1=O)Nc1ccc(c(c1)C)C
STK531695
Synonyms: N,N-dimethyl-N'-(2,8,8-trimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4-yl)propane-1,3-diamine
Smiles: CN(CCCNc1nc(C)nc2c1sc1c2cc2c(n1)CC(OC2)(C)C)C
STK531696
Synonyms: 3-(3-bromophenyl)-2-[(3-methylbutyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CC(CCSc1nc2c3ccccc3CC3(c2c(=O)n1c1cccc(c1)Br)CCCCC3)C
STK531697
Synonyms: 2-[(2E)-2-benzylidenehydrazinyl]-3-(4-methylphenyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: Cc1ccc(cc1)n1c(N/N=C/c2ccccc2)nc2c(c1=O)c1CCCc1s2
STK531698
Synonyms: 4-methoxy-N-{2-oxo-2-[(2E)-2-(1-phenylpropan-2-ylidene)hydrazinyl]ethyl}benzamide(non-preferredname)
Smiles: COc1ccc(cc1)C(=O)NCC(=O)N/N=C(/Cc1ccccc1)\C
STK531699
Synonyms: 1-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-8-tert-butyl-4-(2-methylphenyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: Brc1ccc(cc1)C(=O)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1C)CCC(C3)C(C)(C)C
STK531702
Synonyms: N-[5-(2-{(2E)-2-[2-(benzyloxy)-5-bromobenzylidene]hydrazinyl}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]-2-methylbenzamide
Smiles: O=C(Cc1nnc(s1)NC(=O)c1ccccc1C)N/N=C/c1cc(Br)ccc1OCc1ccccc1
STK531703
Synonyms: 7-cyclohexyl-1-(cyclohexylamino)-3-(morpholin-4-yl)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile
Smiles: N#Cc1c2CCN(Cc2c(nc1N1CCOCC1)NC1CCCCC1)C1CCCCC1
STK531705
Synonyms: ethyl{[2,2-dimethyl-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]sulfanyl}(phenyl)acetate
Smiles: CCOC(=O)C(c1ccccc1)Sc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1
STK531706
Synonyms: 2,4-bis(benzylsulfanyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indole
Smiles: c1ccc(cc1)CSc1nc(SCc2ccccc2)c2c(n1)[nH]c1c2CCCC1
STK531707
Synonyms: 2-methylpropyl4-[(5E)-5-{3-[4-(2-methylpropoxy)-4-oxobutyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoate
Smiles: CC(COC(=O)CCCN1C(=S)S/C(=C\2/SC(=S)N(C2=O)CCCC(=O)OCC(C)C)/C1=O)C
STK531708
Synonyms: 6-hydroxy-2-{[2-(morpholin-4-yl)ethyl]sulfanyl}-3-phenyl-5-propylpyrimidin-4(3H)-one
Smiles: CCCc1c(O)nc(n(c1=O)c1ccccc1)SCCN1CCOCC1
STK531709
Synonyms: 2-(5-amino-1,3,4-thiadiazol-2-yl)-N'-{(E)-[3-bromo-5-ethoxy-4-(2-phenoxyethoxy)phenyl]methylidene}acetohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)Cc2nnc(s2)N)cc(c1OCCOc1ccccc1)Br
STK531710
Synonyms: 7-methyl-3-(4-methylphenyl)-2-[(naphthalen-1-ylmethyl)sulfanyl]-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CN1CCc2c(C1)sc1c2c(=O)n(c(n1)SCc1cccc2c1cccc2)c1ccc(cc1)C
STK531711
Synonyms: 2-(benzylsulfanyl)-8,8-dimethyl-3-(2-methylphenyl)-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Smiles: O=c1n(c(SCc2ccccc2)nc2c1cc1COC(Cc1n2)(C)C)c1ccccc1C
STK531712
Synonyms: 5-methyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-ol
Smiles: Cc1nc2sc3c(c2c2c1CCCC2)ncnc3O
STK531713
Synonyms: N-cyclohexyl-2-[3-(2-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]hydrazinecarbothioamide
Smiles: S=C(NC1CCCCC1)NNc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCCC3
STK531714
Synonyms: (4aS,9bR)-5-[(4-fluorophenyl)sulfonyl]-2,8-dimethyl-2,3,4,4a,5,9b-hexahydro-1H-pyrido[4,3-b]indole
Smiles: CN1CC[C@H]2[C@@H](C1)c1cc(C)ccc1N2S(=O)(=O)c1ccc(cc1)F
STK531715
Synonyms: 6-methyl-2-(propan-2-ylsulfanyl)-5-(prop-2-en-1-yl)pyrimidin-4-ol
Smiles: C=CCc1c(C)nc(nc1O)SC(C)C
STK531717
Synonyms: 4-[(5Z)-5-(4-ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-(4-methylpiperazin-1-yl)butanamide
Smiles: CCc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCCC(=O)NN1CCN(CC1)C
STK531719
Synonyms: 2,2-dimethyl-8-[(2-methylprop-2-en-1-yl)sulfanyl]-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CC(=C)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1
STK531720
Synonyms: 2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-6,6-dimethyl-3-(2-methylphenyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: Clc1ccc(cc1)C(=O)CSc1nc2sc3c(c2c(=O)n1c1ccccc1C)CC(OC3)(C)C
STK531721
Synonyms: 2-(5-amino-1,3,4-thiadiazol-2-yl)-N'-{(E)-[4-(benzyloxy)-3-methoxyphenyl]methylidene}acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)Cc2nnc(s2)N)ccc1OCc1ccccc1
STK531722
Synonyms: 5-oxo-2-propyl-5-[(4-sulfamoylphenyl)amino]pentanoicacid
Smiles: CCCC(C(=O)O)CCC(=O)Nc1ccc(cc1)S(=O)(=O)N
STK531723
Synonyms: 2-[(5-oxo-4-phenyl-5,7-dihydro-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclopentan]-1-yl)sulfanyl]acetamide
Smiles: NC(=O)CSc1nnc2n1c1c3ccccc3CC3(c1c(=O)n2c1ccccc1)CCCC3
STK531724
Synonyms: pentyl1-cyclohexyl-2-{[(2E)-3-phenylprop-2-enoyl]amino}-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCCCCOC(=O)c1c(NC(=O)/C=C/c2ccccc2)n(c2c1nc1ccccc1n2)C1CCCCC1
STK531725
Synonyms: 3-(4-methoxyphenyl)-7-methyl-2-(pentylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CCCCCSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)OC)CCC(C3)C
STK531726
Synonyms: 1-[(3-chloro-4-methylphenyl)amino]-3-methyl-2-octylpyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCCCCCCCc1c(C)c(C#N)c2n(c1Nc1ccc(c(c1)Cl)C)c1ccccc1n2
STK531727
Synonyms: 3-(4-methylphenyl)-2-(propan-2-ylsulfanyl)quinazolin-4(3H)-one
Smiles: CC(Sc1nc2ccccc2c(=O)n1c1ccc(cc1)C)C
STK531729
Synonyms: 2-chloro-N'-{4-[(5Z)-5-(4-ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}benzohydrazide
Smiles: CCc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCCC(=O)NNC(=O)c1ccccc1Cl
STK531730
Synonyms: 2-(butylsulfanyl)-3-(2-methylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CCCCSc1nc2sc3c(c2c(=O)n1c1ccccc1C)CCCC3
STK531733
Synonyms: 1-(benzylamino)-3-methyl-2-octylpyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCCCCCCCc1c(C)c(C#N)c2n(c1NCc1ccccc1)c1ccccc1n2
STK531734
Synonyms: 2,2'-(butane-1,4-diyldisulfanediyl)bis(3-phenyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one)
Smiles: O=c1n(c2ccccc2)c(SCCCCSc2nc3c4ccccc4CC4(c3c(=O)n2c2ccccc2)CCCCC4)nc2c1C1(CCCCC1)Cc1c2cccc1
STK531735
Synonyms: 9-methyl-5-(methylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CSc1nc2sc3c(c2c2n1cnn2)CCC(C3)C
STK531736
Synonyms: 9-(benzylsulfanyl)-8-methyl-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: Cn1c(SCc2ccccc2)nc2c(c1=O)c1CCc3c(c1s2)cccc3
STK531737
Synonyms: benzyl(1Z)-2-(1H-benzimidazol-2-yl)-N-[(2,4-dichlorophenyl)carbonyl]-2-(triphenyl-lambda~5~-phosphanylidene)ethanimidothioate
Smiles: Clc1ccc(c(c1)Cl)C(=O)/N=C(/C(=P(c1ccccc1)(c1ccccc1)c1ccccc1)c1[nH]c2c(n1)cccc2)\SCc1ccccc1
STK531739
Synonyms: 8-chloro-2,2-dimethyl-5-(propan-2-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CC(c1nc2sc3c(c2c2c1COC(C2)(C)C)ncnc3Cl)C
STK531740
Synonyms: ethyl2-{[(4-chlorophenyl)carbonyl]amino}-1-(2-methylphenyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)c2ccc(cc2)Cl)n(c2c1nc1ccccc1n2)c1ccccc1C
STK531741
Synonyms: 4-[(2E)-2-(3-ethoxy-4-hydroxybenzylidene)hydrazinyl]-1-methylquinolin-2(1H)-one
Smiles: CCOc1cc(/C=N/Nc2cc(=O)n(c3c2cccc3)C)ccc1O
STK531743
Synonyms: 9-[(2-oxo-2-phenylethyl)sulfanyl]-8-(prop-2-en-1-yl)-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: C=CCn1c(SCC(=O)c2ccccc2)nc2c(c1=O)c1CCc3c(c1s2)cccc3
STK531744
Synonyms: 2,3,8,8-tetramethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(3H)-one
Smiles: Cn1c(C)nc2c(c1=O)sc1c2cc2c(n1)CC(OC2)(C)C
STK531745
Synonyms: N-(5-{2-[(2E)-2-{4-[(2-chlorobenzyl)oxy]benzylidene}hydrazinyl]-2-oxoethyl}-1,3,4-thiadiazol-2-yl)-2-methylbenzamide
Smiles: O=C(Cc1nnc(s1)NC(=O)c1ccccc1C)N/N=C/c1ccc(cc1)OCc1ccccc1Cl
STK531746
Synonyms: 4-amino-5-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-2-thiol
Smiles: Sc1nc(N)c2c(n1)sc1c2C(C)CCC1
STK531747
Synonyms: 3-(2-methoxyphenyl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: COc1ccccc1n1c(SCC(=O)c2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
STK531748
Synonyms: 2,2-dimethyl-8-(methylsulfanyl)-5-propyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CCCc1nc2sc3c(c2c2c1COC(C2)(C)C)ncnc3SC
STK531749
Synonyms: 2-[(E)-2-(4-hydroxyphenyl)ethenyl]-6-iodo-3-methylquinazolin-4(3H)-one
Smiles: Oc1ccc(cc1)/C=C/c1nc2ccc(cc2c(=O)n1C)I
STK531750
Synonyms: N,N-bis(2-chloroethyl)-4-[(E)-{2-[2,6-dimethyl-5-(prop-2-en-1-yl)pyrimidin-4-yl]hydrazinylidene}methyl]aniline
Smiles: ClCCN(c1ccc(cc1)/C=N/Nc1nc(C)nc(c1CC=C)C)CCCl
STK531751
Synonyms: 8-[(3,4-dichlorobenzyl)sulfanyl]-2,2-dimethyl-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: Clc1ccc(cc1Cl)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1
STK531752
Synonyms: 3-{(E)-[2-(pyridin-2-yl)hydrazinylidene]methyl}-1H-indole
Smiles: c1ccc(nc1)N/N=C/c1c[nH]c2c1cccc2
STK531753
Synonyms: 1-(4-bromophenyl)-2-{[5-(morpholin-4-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl]sulfanyl}ethanone
Smiles: Brc1ccc(cc1)C(=O)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1
STK531754
Synonyms: 2-[(3-chloropropyl)sulfanyl]-3-(4-methoxyphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: ClCCCSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)OC)CCCCC3
STK531756
Synonyms: 2-(5-amino-1,3,4-thiadiazol-2-yl)-N'-[(E)-{4-[2-(4-tert-butylphenoxy)ethoxy]-3,5-dichlorophenyl}methylidene]acetohydrazide
Smiles: O=C(Cc1nnc(s1)N)N/N=C/c1cc(Cl)c(c(c1)Cl)OCCOc1ccc(cc1)C(C)(C)C
STK531757
Synonyms: 4-bromo-2-{(E)-[2-({[(4-methoxyphenyl)acetyl]amino}acetyl)hydrazinylidene]methyl}phenyl(2E)-3-(furan-2-yl)prop-2-enoate(non-preferredname)
Smiles: COc1ccc(cc1)CC(=O)NCC(=O)N/N=C/c1cc(Br)ccc1OC(=O)/C=C/c1ccco1
STK531758
Synonyms: 2-(hexylsulfanyl)-3-(4-methoxyphenyl)-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CCCCCCSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)OC)CCC(C3)C
STK531760
Synonyms: bis(3,4,5-trichlorothiophen-2-yl)methanone
Smiles: O=C(c1sc(c(c1Cl)Cl)Cl)c1sc(c(c1Cl)Cl)Cl
STK531761
Synonyms: 2-(1H-indol-2-yl)-5,7-dipropyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Smiles: CCCC12CN3CC(C2=O)(CN(C1)C3c1cc2c([nH]1)cccc2)CCC
STK531763
Synonyms: 2,2,9a-trimethyl-5-(morpholin-4-yl)-1,4,9,9a,10,11-hexahydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[2,3-e]pyrrolo[1,2-a]pyrimidine-8,12-dione
Smiles: O=C1CCC2(N1c1c(sc3c1c1CC(C)(C)OCc1c(n3)N1CCOCC1)C(=O)N2)C
STK531764
Synonyms: 6,6-dimethyl-2-[(3-methylbutyl)sulfanyl]-3-(2-methylphenyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CC(CCSc1nc2sc3c(c2c(=O)n1c1ccccc1C)CC(OC3)(C)C)C
STK531765
Synonyms: N-(2-{(2Z)-2-[1-(3,4-dichlorophenyl)ethylidene]hydrazinyl}-2-oxoethyl)-3-fluorobenzamide(non-preferredname)
Smiles: O=C(CNC(=O)c1cccc(c1)F)N/N=C(\c1ccc(c(c1)Cl)Cl)/C
STK531766
Synonyms: 2-[(E)-2-(4-chlorophenyl)ethenyl]-3-(naphthalen-1-yl)quinazolin-4(3H)-one
Smiles: Clc1ccc(cc1)/C=C/c1nc2ccccc2c(=O)n1c1cccc2c1cccc2
STK531767
Synonyms: 2-(butylsulfanyl)-3-(4-methoxyphenyl)-8,8-dimethyl-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Smiles: CCCCSc1nc2nc3CC(C)(C)OCc3cc2c(=O)n1c1ccc(cc1)OC
STK531768
Synonyms: N~2~-(2-methoxyethyl)-N-tricyclo[3.3.1.1~3,7~]dec-1-ylglycinamide
Smiles: COCCNCC(=O)NC12CC3CC(C2)CC(C1)C3
STK531769
Synonyms: 2-[(4-amino-5-butyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-phenyl-N-(propan-2-yl)acetamide
Smiles: CCCCc1nnc(n1N)SCC(=O)N(c1ccccc1)C(C)C
STK531770
Synonyms: N'-[(2E)-1-phenylpropan-2-ylidene]-2-[2-(pyridin-2-yl)-1H-benzimidazol-1-yl]acetohydrazide
Smiles: C/C(=N\NC(=O)Cn1c(nc2c1cccc2)c1ccccn1)/Cc1ccccc1
STK531772
Synonyms: 3-(2-methylphenyl)-2-{[3-(4-methylphenyl)-2-oxopropyl]sulfanyl}-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one
Smiles: O=C(Cc1ccc(cc1)C)CSc1nc2nc3CCCCc3cc2c(=O)n1c1ccccc1C
STK531774
Synonyms: N-(2-{(2E)-2-[2-(benzyloxy)-5-bromobenzylidene]hydrazinyl}-2-oxoethyl)-3-fluorobenzamide(non-preferredname)
Smiles: O=C(CNC(=O)c1cccc(c1)F)N/N=C/c1cc(Br)ccc1OCc1ccccc1
STK531775
Synonyms: 9-amino-5-phenyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8(9H)-one
Smiles: Nn1cnc2c(c1=O)sc1c2c2CCCCc2c(n1)c1ccccc1
STK531776
Synonyms: 2-(ethylsulfanyl)-3-(2-methylphenyl)-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCSc1nc2sc3c(c2c(=O)n1c1ccccc1C)CC(OC3)C(C)C
STK531777
Synonyms: 1,4-bis(2-bromoprop-2-en-1-yl)piperazine
Smiles: BrC(=C)CN1CCN(CC1)CC(=C)Br
STK531780
Synonyms: 3-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N'-[(E)-pyridin-3-ylmethylidene]propanehydrazide
Smiles: O=C(CCn1cnc2c1c(=O)n(C)c(=O)n2C)N/N=C/c1cccnc1
STK531781
Synonyms: 1-(benzylsulfanyl)-4-methyl-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Smiles: O=c1n(C)c2nnc(n2c2c1C1(CCCCC1)Cc1c2cccc1)SCc1ccccc1
STK531782
Synonyms: 4-[(5Z)-5-(4-ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-[5-(4-methylbenzyl)-1,3-thiazol-2-yl]butanamide
Smiles: CCc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCCC(=O)Nc1ncc(s1)Cc1ccc(cc1)C
STK531783
Synonyms: 6-iodo-3-(3-methoxyphenyl)-2-[(E)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]quinazolin-4(3H)-one
Smiles: COc1cccc(c1)n1c(/C=C\2/C(=O)Nc3c2cccc3)nc2c(c1=O)cc(cc2)I
STK531784
Synonyms: 8-butoxy-2,2-dimethyl-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CCCCOc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1
STK531785
Synonyms: 2-[(3,4-dichlorobenzyl)sulfanyl]-7-methyl-3-(2-methylphenyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CN1CCc2c(C1)sc1c2c(=O)n(c(n1)SCc1ccc(c(c1)Cl)Cl)c1ccccc1C
STK531786
Synonyms: N-(2-{(2E)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl}-2-oxoethyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide(non-preferredname)
Smiles: O=C(N/N=C(/c1ccc(cc1)Cl)\C)CNC(=O)C1COc2c(O1)cccc2
STK531787
Synonyms: N-{2-oxo-2-[(2E)-2-(1-phenylpropan-2-ylidene)hydrazinyl]ethyl}thiophene-2-carboxamide(non-preferredname)
Smiles: O=C(CNC(=O)c1cccs1)N/N=C(/Cc1ccccc1)\C
STK531788
Synonyms: N,N-dibenzyl-5-(morpholin-4-yl)-1,2,3,4-tetrahydro[1,2,3]triazino[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine
Smiles: O1CCN(CC1)c1nc2sc3c(c2c2c1CCCC2)nnnc3N(Cc1ccccc1)Cc1ccccc1
STK531789
Synonyms: 2-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-5-methylimidazo[1,2-a]pyridine
Smiles: Cc1nc(SCc2nc3n(c2)c(C)ccc3)nc(c1)C
STK531790
Synonyms: 7,7'-(4,4',5,5'-tetraphenyl-1,1'-biimidazole-2,2'-diyl)diquinoline
Smiles: c1ccc(cc1)c1c(nc(n1n1c(nc(c1c1ccccc1)c1ccccc1)c1ccc2c(c1)nccc2)c1ccc2c(c1)nccc2)c1ccccc1
STK531791
Synonyms: 2-(1H-benzimidazol-2-yl)-N-[(E)-(2,5-dimethoxyphenyl)methylidene]aniline
Smiles: COc1ccc(c(c1)/C=N/c1ccccc1c1nc2c([nH]1)cccc2)OC
STK531793
Synonyms: (2E)-N-(2-{(2E)-2-[(2-ethoxynaphthalen-1-yl)methylidene]hydrazinyl}-2-oxoethyl)-3-phenylprop-2-enamide(non-preferredname)
Smiles: CCOc1ccc2c(c1/C=N/NC(=O)CNC(=O)/C=C/c1ccccc1)cccc2
STK531795
Synonyms: 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-7-tert-butyl-3-(2-methylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: Brc1ccc(cc1)C(=O)CSc1nc2sc3c(c2c(=O)n1c1ccccc1C)CCC(C3)C(C)(C)C
STK531796
Synonyms: 1-(1H-benzimidazol-1-yl)-3-methyl-2-octylpyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCCCCCCCc1c(C)c(C#N)c2n(c1n1cnc3c1cccc3)c1ccccc1n2
STK531799
Synonyms: N'-[(2Z)-4-methylpentan-2-ylidene]-1H-indole-3-carbohydrazide
Smiles: CC(C/C(=N\NC(=O)c1c[nH]c2c1cccc2)/C)C
STK531800
Synonyms: 11-{[2-(piperidin-1-yl)ethyl]amino}-2,3-dihydro-1H-cyclopenta[4,5]pyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: N#Cc1c2CCCc2c(n2c1nc1c2cccc1)NCCN1CCCCC1
STK531801
Synonyms: 2,4-bis[(2-methylpropyl)sulfanyl]-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indole
Smiles: CC(CSc1nc(SCC(C)C)c2c(n1)[nH]c1c2CCCC1)C
STK531802
Synonyms: (2Z)-2-[(8E)-8-(2-carbamoylhydrazinylidene)-1,8-diphenyloctylidene]hydrazinecarboxamide
Smiles: NC(=O)N/N=C(\c1ccccc1)/CCCCCC/C(=N\NC(=O)N)/c1ccccc1
STK531803
Synonyms: 2-[(3-methylbutyl)sulfanyl]-3-(2-methylphenyl)-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one
Smiles: CC(CCSc1nc2nc3CCCCc3cc2c(=O)n1c1ccccc1C)C
STK531804
Synonyms: 4-[(E)-{[2-(1H-benzimidazol-2-yl)phenyl]imino}methyl]benzene-1,3-diol
Smiles: Oc1ccc(c(c1)O)/C=N/c1ccccc1c1nc2c([nH]1)cccc2
STK531806
Synonyms: 8-(benzylsulfanyl)-2,2-dimethyl-5-propyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CCCc1nc2sc3c(c2c2c1COC(C2)(C)C)ncnc3SCc1ccccc1
STK531807
Synonyms: N-(3'-cyano-1'H-spiro[cyclohexane-1,2'-naphthalen]-4'-yl)-2-{[3-(furan-2-ylmethyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: N#CC1=C(NC(=O)CSc2nc3c4ccccc4CC4(c3c(=O)n2Cc2ccco2)CCCCC4)c2ccccc2CC21CCCCC2
STK531808
Synonyms: pentyl1-cyclohexyl-2-[(phenylcarbonyl)amino]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCCCCOC(=O)c1c(NC(=O)c2ccccc2)n(c2c1nc1ccccc1n2)C1CCCCC1
STK531810
Synonyms: 1-[4-(9H-fluoren-9-yl)piperazin-1-yl]-3-methyl-2-octylpyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCCCCCCCc1c(C)c(C#N)c2n(c1N1CCN(CC1)C1c3ccccc3c3c1cccc3)c1ccccc1n2
STK531811
Synonyms: 2-(3-benzyl-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl)-N-(2-methylprop-2-en-1-yl)hydrazinecarbothioamide
Smiles: CC(=C)CNC(=S)NNc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccccc1)CCCCC3
STK531812
Synonyms: 2-[(4-amino-5-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-1-phenylethanone
Smiles: O=C(c1ccccc1)CSc1nc(N)c2c(n1)sc1c2C(C)CCC1
STK531813
Synonyms: 2,2'-(butane-1,4-diyldisulfanediyl)bis[3-(2-methylphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one]
Smiles: O=c1n(c(SCCCCSc2nc3c4ccccc4CC4(c3c(=O)n2c2ccccc2C)CCCCC4)nc2c1C1(CCCCC1)Cc1c2cccc1)c1ccccc1C
STK531814
Synonyms: 4-chloro-N-[4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,3-thiazol-2-yl]benzamide
Smiles: Clc1ccc(cc1)C(=O)Nc1scc(n1)C12CC3CC(C2)CC(C1)C3
STK531815
Synonyms: N-(2-{(2E)-2-[1-(furan-2-yl)ethylidene]hydrazinyl}-2-oxoethyl)-3-methoxybenzamide(non-preferredname)
Smiles: COc1cccc(c1)C(=O)NCC(=O)N/N=C(/c1ccco1)\C
STK531816
Synonyms: 2-[(2-methylpropyl)sulfanyl]pyrimidine-4,6-diol
Smiles: CC(CSc1nc(O)cc(n1)O)C
STK531817
Synonyms: 1-[(4-ethoxyphenyl)amino]-3-methyl-2-octylpyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCCCCCCCc1c(C)c(C#N)c2n(c1Nc1ccc(cc1)OCC)c1ccccc1n2
STK531818
Synonyms: 2-(1H-benzimidazol-2-yl)-N-[(E)-(3,4,5-trimethoxyphenyl)methylidene]aniline
Smiles: COc1cc(/C=N/c2ccccc2c2nc3c([nH]2)cccc3)cc(c1OC)OC
STK531819
Synonyms: 2-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-3-bromoimidazo[1,2-a]pyrimidine
Smiles: Brc1c(CSc2nc3c(s2)cccc3)nc2n1cccn2
STK531821
Synonyms: 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-(2-methylphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: Brc1ccc(cc1)C(=O)CSc1nc2sc3c(c2c(=O)n1c1ccccc1C)CCCC3
STK531822
Synonyms: 2-(heptylsulfanyl)-3-(2-methoxyphenyl)quinazolin-4(3H)-one
Smiles: CCCCCCCSc1nc2ccccc2c(=O)n1c1ccccc1OC
STK531823
Synonyms: benzene-1,2-diylbis[(3,4,5-trichlorothiophen-2-yl)methanone]
Smiles: O=C(c1sc(c(c1Cl)Cl)Cl)c1ccccc1C(=O)c1sc(c(c1Cl)Cl)Cl
STK531825
Synonyms: N-{2-[(2E)-2-(2,4-dihydroxybenzylidene)hydrazinyl]-2-oxoethyl}pyridine-4-carboxamide(non-preferredname)
Smiles: O=C(CNC(=O)c1ccncc1)N/N=C/c1ccc(cc1O)O
STK531826
Synonyms: 5-[(E)-{[(4-butoxy-3-chlorobenzyl)oxy]imino}methyl]-6-methylpyrimidine-2,4(1H,3H)-dione
Smiles: CCCCOc1ccc(cc1Cl)CO/N=C/c1c(C)[nH]c(=O)[nH]c1=O
STK531827
Synonyms: 2-(dimethylamino)ethyl4-[(5Z)-5-benzylidene-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoate
Smiles: CN(CCOC(=O)CCCN1C(=S)S/C(=C\c2ccccc2)/C1=O)C
STK531828
Synonyms: N'-[(3E)-5,7-dibromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2-[2-(pyridin-2-yl)-1H-benzimidazol-1-yl]acetohydrazide
Smiles: Brc1cc(Br)c2c(c1)/C(=N\NC(=O)Cn1c(nc3c1cccc3)c1ccccn1)/C(=O)N2
STK531829
Synonyms: ethyl{[3-(2-methoxyphenyl)-4-oxo-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccccc1OC)CCC3
STK531830
Synonyms: 3-methyl-2-(propylsulfanyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CCCSc1nc2c3ccccc3CC3(c2c(=O)n1C)CCCCC3
STK531831
Synonyms: 4-bromo-N-(2-{(2E)-2-[1-(furan-2-yl)ethylidene]hydrazinyl}-2-oxoethyl)benzamide(non-preferredname)
Smiles: O=C(N/N=C(/c1ccco1)\C)CNC(=O)c1ccc(cc1)Br
STK531832
Synonyms: N-(furan-2-ylmethyl)-2,2-dimethyl-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-amine
Smiles: CC1(C)OCc2c(C1)c1c(nc2N2CCOCC2)sc2c1ncnc2NCc1ccco1
STK531833
Synonyms: 7,7-dimethyl-2-(piperidin-1-yl)-7,8-dihydro-5H-pyrano[4,3-b]pyridine-3-carbonitrile
Smiles: N#Cc1cc2COC(Cc2nc1N1CCCCC1)(C)C
STK531834
Synonyms: 2-(hexylsulfanyl)-3-(4-methylphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: CCCCCCSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)C)CCCC3
STK531835
Synonyms: 4,4-dimethyl-2,6-bis(3-methylphenyl)-3,5-dinitropiperidine
Smiles: [O-][N+](=O)C1C(NC(C(C1(C)C)[N+](=O)[O-])c1cccc(c1)C)c1cccc(c1)C
STK531836
Synonyms: 2-benzyl-1-[4-(9H-fluoren-9-yl)piperazin-1-yl]-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: N#Cc1c(C)c(Cc2ccccc2)c(n2c1nc1c2cccc1)N1CCN(CC1)C1c2ccccc2c2c1cccc2
STK531837
Synonyms: N-(2-{(2E)-2-[(2-methyl-1H-indol-3-yl)methylidene]hydrazinyl}-2-oxoethyl)-2,2-diphenylacetamide(non-preferredname)
Smiles: O=C(CNC(=O)C(c1ccccc1)c1ccccc1)N/N=C/c1c(C)[nH]c2c1cccc2
STK531838
Synonyms: 2,7-bis[(dipropylamino)methyl]-1,8-bis(4-methoxyphenyl)octane-1,8-dione
Smiles: CCCN(CC(C(=O)c1ccc(cc1)OC)CCCCC(C(=O)c1ccc(cc1)OC)CN(CCC)CCC)CCC
STK531839
Synonyms: 2-{[4-amino-6-(propan-2-yl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}-1-(4-chlorophenyl)ethanone
Smiles: CC(C1OCc2c(C1)c1c(N)nc(nc1s2)SCC(=O)c1ccc(cc1)Cl)C
STK531840
Synonyms: N-(2-{(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl}-2-oxoethyl)-3,4-dimethoxybenzamide(non-preferredname)
Smiles: COc1cc(ccc1OC)C(=O)NCC(=O)N/N=C(\c1ccc(cc1)Cl)/C
STK531841
Synonyms: N-(2-{(2E)-2-[(2-methyl-1H-indol-3-yl)methylidene]hydrazinyl}-2-oxoethyl)-2-phenoxyacetamide(non-preferredname)
Smiles: O=C(CNC(=O)COc1ccccc1)N/N=C/c1c(C)[nH]c2c1cccc2
STK531842
Synonyms: 8-(heptylsulfanyl)-5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: CCCCCCCSc1ncnc2c1sc1c2c2CCCCc2c(n1)CCC
STK531843
Synonyms: 4-methyl-N-[5-methyl-4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,3-thiazol-2-yl]benzamide
Smiles: Cc1ccc(cc1)C(=O)Nc1sc(c(n1)C12CC3CC(C2)CC(C1)C3)C
STK531844
Synonyms: (2E)-N-{2-[(2E)-2-(5-bromo-2-methoxybenzylidene)hydrazinyl]-2-oxoethyl}-3-(2-methoxyphenyl)prop-2-enamide(non-preferredname)
Smiles: COc1ccccc1/C=C/C(=O)NCC(=O)N/N=C/c1cc(Br)ccc1OC
STK531845
Synonyms: 6-({(2Z)-3-(4-fluorophenyl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}amino)hexanoicacid
Smiles: OC(=O)CCCCCNC(=O)/C(=C/c1ccc(cc1)F)/NC(=O)c1ccccc1
STK531846
Synonyms: N-{3-chloro-4-[(1-chloronaphthalen-2-yl)oxy]phenyl}-2-(4-ethylpiperazin-1-yl)-5-nitrobenzamide
Smiles: CCN1CCN(CC1)c1ccc(cc1C(=O)Nc1ccc(c(c1)Cl)Oc1ccc2c(c1Cl)cccc2)[N+](=O)[O-]
STK531847
Synonyms: 4-(heptyloxy)-8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CCCCCCCOc1ncnc2c1sc1c2cc2c(n1)CC(OC2)(C)C
STK531848
Synonyms: 3-ethyl-2-hydrazinyl-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCn1c(NN)nc2c(c1=O)c1CCCc1s2
STK531851
Synonyms: 8-methyl-4-(4-methylphenyl)-1-[(2-oxo-2-phenylethyl)sulfanyl]-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CN1CCc2c(C1)sc1c2c(=O)n(c2n1c(SCC(=O)c1ccccc1)nn2)c1ccc(cc1)C
STK531853
Synonyms: N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-amine
Smiles: C1CCc2c(C1)c1c(NCC3OCCc4c3cccc4)ncnc1s2
STK531854
Synonyms: ethyl3-[(2E)-2-(2-carbamoylhydrazinylidene)propyl]-2-oxo-5-[(pentyloxy)methyl]tetrahydrofuran-3-carboxylate(non-preferredname)
Smiles: CCCCCOCC1OC(=O)C(C1)(C/C(=N/NC(=O)N)/C)C(=O)OCC
STK531855
Synonyms: methyl{[3-(2-methylphenyl)-4-oxo-3,4,6,7,8,9-hexahydropyrimido[4,5-b]quinolin-2-yl]sulfanyl}acetate
Smiles: COC(=O)CSc1nc2nc3CCCCc3cc2c(=O)n1c1ccccc1C
STK531857
Synonyms: N,N-dibutyl-5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine
Smiles: CCCCN(c1ncnc2c1sc1c2c2CCCCc2c(n1)CCC)CCCC
STK531858
Synonyms: 4-bromo-N'-[3-(2-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]benzohydrazide
Smiles: Brc1ccc(cc1)C(=O)NNc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCCC3
STK531859
Synonyms: 5,7-dimethyl-2-(3-methylphenyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-ol
Smiles: Cc1cccc(c1)C1N2CC3(CN1CC(C2)(C3O)C)C
STK531860
Synonyms: (6E)-6-[2-(benzyloxy)benzylidene]-5-imino-2-(trifluoromethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: O=C1N=c2sc(nn2C(=N)/C/1=C\c1ccccc1OCc1ccccc1)C(F)(F)F
STK531861
Synonyms: (6Z)-6-{[1-(2-fluorobenzyl)-1H-indol-3-yl]methylidene}-2-heptyl-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCCCCCCc1nn2c(=NC(=O)/C(=C\c3cn(c4c3cccc4)Cc3ccccc3F)/C2=N)s1
STK531862
Synonyms: 2-hydrazinyl-3-(2-methoxyphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: NNc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1OC)CCCCC3
STK531863
Synonyms: 2-[(7-methyl-4-oxo-3-phenyl-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-phenylacetamide
Smiles: CN1CCc2c(C1)sc1c2c(=O)n(c(n1)SCC(=O)Nc1ccccc1)c1ccccc1
STK531864
Synonyms: N-(2-{(2E)-2-[1-(furan-2-yl)ethylidene]hydrazinyl}-2-oxoethyl)-2-methoxybenzamide(non-preferredname)
Smiles: COc1ccccc1C(=O)NCC(=O)N/N=C(/c1ccco1)\C
STK531865
Synonyms: 8-(heptylsulfanyl)-5-(morpholin-4-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: CCCCCCCSc1ncnc2c1sc1c2c2CCCCc2c(n1)N1CCOCC1
STK531866
Synonyms: 2,2-dimethyl-8-[(2-phenylethyl)sulfanyl]-5-(propan-2-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CC(c1nc2sc3c(c2c2c1COC(C2)(C)C)ncnc3SCCc1ccccc1)C
STK531870
Synonyms: 1-(4-ethoxy-3-nitrobenzyl)-2-methyl-4-nitro-1H-imidazole-5-thiol
Smiles: CCOc1ccc(cc1[N+](=O)[O-])Cn1c(C)nc(c1S)[N+](=O)[O-]
STK531872
Synonyms: 3-(2-methylphenyl)-2-(pentylsulfanyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCCCCSc1nc2sc3c(c2c(=O)n1c1ccccc1C)CCC3
STK531873
Synonyms: 3-(furan-2-ylmethyl)-2-hydrazinyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: NNc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCCC3
STK531874
Synonyms: ethyl{[3-(2-methylphenyl)-4-oxo-3,4,6,7,8,9-hexahydropyrimido[4,5-b]quinolin-2-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nc2nc3CCCCc3cc2c(=O)n1c1ccccc1C
STK531875
Synonyms: 6-[(2E)-2-(1H-indol-3-ylmethylidene)hydrazinyl]phenanthridine
Smiles: c1ccc2c(c1)c(/C=N/Nc1nc3ccccc3c3c1cccc3)c[nH]2
STK531877
Synonyms: 3-methoxy-N-{2-oxo-2-[(2E)-2-(1-phenylpropan-2-ylidene)hydrazinyl]ethyl}benzamide(non-preferredname)
Smiles: COc1cccc(c1)C(=O)NCC(=O)N/N=C(/Cc1ccccc1)\C
STK531878
Synonyms: 2-({[1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]amino}methyl)phenol
Smiles: CC(C12CC3CC(C2)CC(C1)C3)NCc1ccccc1O
STK531879
Synonyms: 8-chloro-5-methyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: Cc1nc2sc3c(c2c2c1CCCC2)ncnc3Cl
STK531880
Synonyms: 6-methyl-1-[(3-methylbutyl)sulfanyl]-4-(4-methylphenyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CC(CCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccc(cc1)C)C(C)CCC3)C
STK531882
Synonyms: methyl{[7-tert-butyl-3-(2-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
Smiles: COC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccccc1C)CCC(C3)C(C)(C)C
STK531883
Synonyms: N-{2-[(2E)-2-(2,4-dihydroxybenzylidene)hydrazinyl]-2-oxoethyl}-2-phenylacetamide(non-preferredname)
Smiles: O=C(CNC(=O)Cc1ccccc1)N/N=C/c1ccc(cc1O)O
STK531884
Synonyms: 4-(2-methylphenyl)-1-sulfanyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: Cc1ccccc1n1c(=O)c2c3CCCCc3sc2n2c1nnc2S
STK531885
Synonyms: 5-(propan-2-yl)-8-(propan-2-yloxy)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: CC(Oc1ncnc2c1sc1c2c2CCCCc2c(n1)C(C)C)C
STK531886
Synonyms: ethyl{[3-(4-methoxyphenyl)-7-methyl-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)OC)CCN(C3)C
STK531887
Synonyms: 2,2-dimethyl-8-[(2-methylprop-2-en-1-yl)sulfanyl]-5-(propan-2-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CC(=C)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)C(C)C
STK531889
Synonyms: 3-[(Z)-{2-[(5-{[(4-methoxyphenyl)carbonyl]amino}-1,3,4-thiadiazol-2-yl)acetyl]hydrazinylidene}methyl]phenyl4-methylbenzenesulfonate
Smiles: COc1ccc(cc1)C(=O)Nc1nnc(s1)CC(=O)N/N=C\c1cccc(c1)OS(=O)(=O)c1ccc(cc1)C
STK531890
Synonyms: 2-{[(6,8-dibromo-2-oxo-2H-chromen-3-yl)carbonyl]amino}benzoicacid
Smiles: Brc1cc(Br)c2c(c1)cc(c(=O)o2)C(=O)Nc1ccccc1C(=O)O
STK531891
Synonyms: 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-(furan-2-ylmethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: Brc1ccc(cc1)C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCCC3
STK531894
Synonyms: 2-(5-amino-1,3,4-thiadiazol-2-yl)-N'-[(E)-{5-bromo-2-[2-(3-ethyl-5-methylphenoxy)ethoxy]phenyl}methylidene]acetohydrazide
Smiles: CCc1cc(OCCOc2ccc(cc2/C=N/NC(=O)Cc2nnc(s2)N)Br)cc(c1)C
STK531895
Synonyms: N'-[(1Z)-1-(4-chlorophenyl)ethylidene]-2-[2-(pyridin-2-yl)-1H-benzimidazol-1-yl]acetohydrazide
Smiles: O=C(Cn1c(nc2c1cccc2)c1ccccn1)N/N=C(\c1ccc(cc1)Cl)/C
STK531897
Synonyms: 2-[(Z)-(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-3-ethyl-6-iodoquinazolin-4(3H)-one
Smiles: CCn1c(/C=C/2\C(=O)Nc3c2cc(Br)cc3)nc2c(c1=O)cc(cc2)I
STK531898
Synonyms: 1-(butylsulfanyl)-4-(2-methoxyphenyl)-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CCCCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1OC)CCC3
STK531899
Synonyms: 2-{[(tricyclo[4.3.1.1~3,8~]undec-1-ylmethyl)amino]methyl}phenol
Smiles: Oc1ccccc1CNCC12CC3CCC(C1)CC(C2)C3
STK531900
Synonyms: 2,2-dimethyl-5-(2-methylpropyl)-N-(2-phenylethyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-amine
Smiles: CC(Cc1nc2sc3c(c2c2c1COC(C2)(C)C)ncnc3NCCc1ccccc1)C
STK531901
Synonyms: (6E)-6-{3-[(2,4-dichlorobenzyl)oxy]benzylidene}-5-imino-2-(trifluoromethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: Clc1ccc(c(c1)Cl)COc1cccc(c1)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)C(F)(F)F
STK531902
Synonyms: 3-(2-methylphenyl)-2-(propylsulfanyl)-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one
Smiles: CCCSc1nc2nc3CCCCc3cc2c(=O)n1c1ccccc1C
STK531903
Synonyms: 2-(2-chlorophenyl)-5,7-diethyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Smiles: CCC12CN3CC(C2=O)(CN(C1)C3c1ccccc1Cl)CC
STK531904
Synonyms: ethyl{[3-(2-methylphenyl)-4-oxo-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccccc1C)CC(OC3)C(C)C
STK531905
Synonyms: 2-(heptylsulfanyl)-6,6-dimethyl-3-(2-methylphenyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCCCCCCSc1nc2sc3c(c2c(=O)n1c1ccccc1C)CC(OC3)(C)C
STK531906
Synonyms: N-(2-bromophenyl)-4-[(5E)-5-(3-{4-[(2-bromophenyl)amino]-4-oxobutyl}-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanamide
Smiles: O=C(Nc1ccccc1Br)CCCN1C(=S)S/C(=C\2/SC(=S)N(C2=O)CCCC(=O)Nc2ccccc2Br)/C1=O
STK531907
Synonyms: 1-(3,4-dimethoxyphenyl)-N-[(1-phenylcyclopentyl)methyl]methanamine
Smiles: COc1cc(CNCC2(CCCC2)c2ccccc2)ccc1OC
STK531908
Synonyms: 2-(1-benzyl-1H-indol-3-yl)-6,6-dimethyl-5,7-dinitro-1,3-diazatricyclo[3.3.1.1~3,7~]decane
Smiles: [O-][N+](=O)C12CN3CC(C2(C)C)(CN(C1)C3c1cn(c2c1cccc2)Cc1ccccc1)[N+](=O)[O-]
STK531909
Synonyms: 8-chloro-2-methyl-4-phenoxy-3-(prop-2-en-1-yl)quinoline
Smiles: C=CCc1c(C)nc2c(c1Oc1ccccc1)cccc2Cl
STK531911
Synonyms: (6E)-6-{3-chloro-4-[(2-chlorobenzyl)oxy]-5-ethoxybenzylidene}-5-imino-2-(trifluoromethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCOc1cc(cc(c1OCc1ccccc1Cl)Cl)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)C(F)(F)F
STK531912
Synonyms: 2-[(1-imino-9,9-dimethyl-2,5-diphenyl-6-thioxo-2,5,6,7,9,10-hexahydro-1H-pyrano[4',3':4,5]pyrido[2,3-d]pyrimidin-3-yl)sulfanyl]-N-(2-methoxyphenyl)acetamide
Smiles: COc1ccccc1NC(=O)CSc1nc2c(c(=N)n1c1ccccc1)c1CC(C)(C)OCc1c(=S)n2c1ccccc1
STK531913
Synonyms: ethyl5,5-dimethyl-2-(undec-10-enoylamino)-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate
Smiles: C=CCCCCCCCCC(=O)Nc1sc2c(c1C(=O)OCC)CC(OC2)(C)C
STK531914
Synonyms: N'-(6,6-dimethyl-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)benzohydrazide
Smiles: O=C(c1ccccc1)NNc1nc2sc3c(c2c(=O)[nH]1)CC(OC3)(C)C
STK531915
Synonyms: 5-methyl-2-[(2-methylprop-2-en-1-yl)sulfanyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-amine
Smiles: CC(=C)CSc1nc(N)c2c(n1)sc1c2C(C)CCC1
STK531916
Synonyms: 8-(2-methylphenyl)-9-[(2-oxo-2-phenylethyl)sulfanyl]-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: O=C(c1ccccc1)CSc1nc2sc3c(c2c(=O)n1c1ccccc1C)CCc1c3cccc1
STK531917
Synonyms: 3-methoxy-N-(2-{(2E)-2-[(2-methyl-1H-indol-3-yl)methylidene]hydrazinyl}-2-oxoethyl)benzamide(non-preferredname)
Smiles: COc1cccc(c1)C(=O)NCC(=O)N/N=C/c1c(C)[nH]c2c1cccc2
STK531918
Synonyms: 1-phenoxy-3-[(4-phenylbutan-2-yl)amino]propan-2-ol
Smiles: CC(CCc1ccccc1)NCC(COc1ccccc1)O
STK531919
Synonyms: 8-[(4-bromobenzyl)sulfanyl]-2,2-dimethyl-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: Brc1ccc(cc1)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1
STK531920
Synonyms: 7,9-dibromo-2,3-dibutoxy-6-pentyl-6H-indolo[2,3-b]quinoxaline
Smiles: CCCCOc1cc2nc3n(CCCCC)c4c(c3nc2cc1OCCCC)cc(cc4Br)Br
STK531921
Synonyms: N-{2-oxo-2-[(2Z)-2-(1-phenylpropan-2-ylidene)hydrazinyl]ethyl}-2,2-diphenylacetamide(non-preferredname)
Smiles: O=C(CNC(=O)C(c1ccccc1)c1ccccc1)N/N=C(\Cc1ccccc1)/C
STK531922
Synonyms: 3-amino-2-(3-phenylpropyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: Nn1c(CCCc2ccccc2)nc2c(c1=O)c1CCCCc1s2
STK531924
Synonyms: 2-[(E)-2-(2-chlorophenyl)ethenyl]-3-(3-methylphenyl)quinazolin-4(3H)-one
Smiles: Cc1cccc(c1)n1c(/C=C/c2ccccc2Cl)nc2c(c1=O)cccc2
STK531927
Synonyms: [(methylphosphoryl)bis(benzene-2,1-diyloxymethanediyl)]bis(diphenylphosphane)dioxide
Smiles: CP(=O)(c1ccccc1OCP(=O)(c1ccccc1)c1ccccc1)c1ccccc1OCP(=O)(c1ccccc1)c1ccccc1
STK531928
Synonyms: 2-[(2,4-dimethylbenzyl)sulfanyl]-3-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: Cc1ccc(c(c1)C)CSc1nc2c3ccccc3CC3(c2c(=O)n1C1CCOC(C1)(C)C)CCCCC3
STK531929
Synonyms: 2-(5-amino-1,3,4-thiadiazol-2-yl)-N'-[(E)-{3-bromo-5-ethoxy-4-[2-(3-ethyl-5-methylphenoxy)ethoxy]phenyl}methylidene]acetohydrazide
Smiles: CCOc1cc(/C=N/NC(=O)Cc2nnc(s2)N)cc(c1OCCOc1cc(C)cc(c1)CC)Br
STK531930
Synonyms: 8-benzyl-9-sulfanyl-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: Sc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CCc1c3cccc1
STK531932
Synonyms: 4-(4-benzylpiperazin-1-yl)-1-methyl-3-nitroquinolin-2(1H)-one
Smiles: Cn1c(=O)c([N+](=O)[O-])c(c2c1cccc2)N1CCN(CC1)Cc1ccccc1
STK531933
Synonyms: 2-(butylsulfanyl)-3-(2-methylphenyl)-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one
Smiles: CCCCSc1nc2nc3CCCCc3cc2c(=O)n1c1ccccc1C
STK531935
Synonyms: 5-methyl-8-(propylsulfanyl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: CCCSc1ncnc2c1sc1c2c2CCCCc2c(n1)C
STK531936
Synonyms: 4-(2-methoxyphenyl)-1-(prop-2-en-1-ylsulfanyl)-7,8-dihydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: C=CCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1OC)CCC3
STK531937
Synonyms: (6E)-5-imino-6-({1-[2-(4-methoxyphenoxy)ethyl]-1H-indol-3-yl}methylidene)-2-(trifluoromethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: COc1ccc(cc1)OCCn1cc(c2c1cccc2)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)C(F)(F)F
STK531938
Synonyms: dipropan-2-yl[(2-fluorophenyl)(phenylamino)methyl]phosphonate
Smiles: CC(OP(=O)(C(c1ccccc1F)Nc1ccccc1)OC(C)C)C
STK531939
Synonyms: N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-N~3~,N~3~-dimethyl-beta-alaninamide
Smiles: CN(CCC(=O)NCC1OCCc2c1cccc2)C
STK531940
Synonyms: 4-chloro-N'-{4-[(5Z)-5-(4-ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}benzohydrazide
Smiles: CCc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCCC(=O)NNC(=O)c1ccc(cc1)Cl
STK531941
Synonyms: 3-(4-methoxyphenyl)-2-[(3-{[3-(4-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}propyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: COc1ccc(cc1)n1c(SCCCSc2nc3c4ccccc4CC4(c3c(=O)n2c2ccc(cc2)C)CCCCC4)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
STK531942
Synonyms: 8-(prop-2-en-1-ylsulfanyl)-5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: CCCc1nc2sc3c(c2c2c1CCCC2)ncnc3SCC=C
STK531944
Synonyms: N'-[(1Z)-1-(3,4-dichlorophenyl)ethylidene]-2,2-diphenylcyclopropanecarbohydrazide
Smiles: O=C(C1CC1(c1ccccc1)c1ccccc1)N/N=C(\c1ccc(c(c1)Cl)Cl)/C
STK531945
Synonyms: 2,2-dimethyl-5-(morpholin-4-yl)-8-propoxy-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazine
Smiles: CCCOc1nnnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1
STK531946
Synonyms: 1-{1-chloro-4-(2,4-dichlorophenyl)-2-[(2-nitrophenyl)sulfanyl]-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinolin-8-yl}ethanone
Smiles: Clc1ccc(c(c1)Cl)C1Nc2ccc(cc2C2C1CC(C2Cl)Sc1ccccc1[N+](=O)[O-])C(=O)C
STK531947
Synonyms: (5Z)-3-[4-(2-chloro-10H-phenothiazin-10-yl)-4-oxobutyl]-5-(4-ethylbenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: CCc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCCC(=O)N1c2ccccc2Sc2c1cc(Cl)cc2
STK531948
Synonyms: N-(2-methoxyphenyl)-2-{[3-(2-methylphenyl)-4-oxo-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Smiles: COc1ccccc1NC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccccc1C)CCC3
STK531949
Synonyms: 2,3-dipropoxy-6-propyl-6H-indolo[2,3-b]quinoxaline
Smiles: CCCOc1cc2nc3c(nc2cc1OCCC)c1c(n3CCC)cccc1
STK531950
Synonyms: N-(phenylcarbamothioyl)tricyclo[4.3.1.1~3,8~]undecane-1-carboxamide
Smiles: S=C(NC(=O)C12CC3CCC(C1)CC(C2)C3)Nc1ccccc1
STK531951
Synonyms: 2-[(E)-2-(2-chlorophenyl)ethenyl]-6-iodo-3-(4-methylphenyl)quinazolin-4(3H)-one
Smiles: Cc1ccc(cc1)n1c(/C=C/c2ccccc2Cl)nc2c(c1=O)cc(cc2)I
STK531952
Synonyms: 2-{[4-amino-5-(trifluoromethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-phenyl-N-(propan-2-yl)acetamide
Smiles: CC(N(c1ccccc1)C(=O)CSc1nnc(n1N)C(F)(F)F)C
STK531953
Synonyms: 2-{8-[4-(2-hydroxyethyl)piperazin-1-yl]-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}ethyl3,4,5-trimethoxybenzoate
Smiles: OCCN1CCN(CC1)c1nc2c(n1CCOC(=O)c1cc(OC)c(c(c1)OC)OC)c(=O)n(c(=O)n2C)C
STK531954
Synonyms: 2-phenyl-N-(2,2,2-trichloro-1-{[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)carbamothioyl]amino}ethyl)acetamide
Smiles: S=C(NC(C(Cl)(Cl)Cl)NC(=O)Cc1ccccc1)Nc1c(=O)n(n(c1C)C)c1ccccc1
STK531956
Synonyms: 4-bromo-N-[4-(imidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
Smiles: Brc1ccc(cc1)C(=O)Nc1ccc(cc1)c1nc2n(c1)cccc2
STK531957
Synonyms: 2,4-bis(pentylsulfanyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]indole
Smiles: CCCCCSc1nc(SCCCCC)c2c(n1)[nH]c1c2CCCC1
STK531958
Synonyms: 2-{[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]sulfanyl}-1H-benzimidazole
Smiles: Clc1ccc2n(c1)cc(n2)CSc1nc2c([nH]1)cccc2
STK531959
Synonyms: N-butyl-2,2,5-trimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-amine
Smiles: CCCCNc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)C
STK531961
Synonyms: 2-[(4-methoxybenzyl)sulfanyl]-5-methyl-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: COc1ccc(cc1)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)C(C)CCC3
STK531962
Synonyms: N-(2-{(2E)-2-[1-(3,4-dichlorophenyl)ethylidene]hydrazinyl}-2-oxoethyl)furan-2-carboxamide(non-preferredname)
Smiles: O=C(CNC(=O)c1ccco1)N/N=C(/c1ccc(c(c1)Cl)Cl)\C
STK531963
Synonyms: 1,6-bis(4-butoxyphenyl)-2,5-bis[(dimethylamino)methyl]hexane-1,6-dione
Smiles: CCCCOc1ccc(cc1)C(=O)C(CN(C)C)CCC(C(=O)c1ccc(cc1)OCCCC)CN(C)C
STK531964
Synonyms: 2-(ethylsulfanyl)-3-(prop-2-en-1-yl)-2,3-dihydro-1H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: C=CCN1C(SCC)NC2=C(C1=O)C1(CCCC1)Cc1c2cccc1
STK531965
Synonyms: 2-[4-hydroxy-2-(2-methylpropyl)pentanoyl]-N-(prop-2-en-1-yl)hydrazinecarbothioamide
Smiles: C=CCNC(=S)NNC(=O)C(CC(O)C)CC(C)C
STK531966
Synonyms: ethylbis{[2-(diphenylphosphoryl)phenoxy]methyl}phosphinate
Smiles: CCOP(=O)(COc1ccccc1P(=O)(c1ccccc1)c1ccccc1)COc1ccccc1P(=O)(c1ccccc1)c1ccccc1
STK531967
Synonyms: 6,6-dimethyl-3-(2-methylphenyl)-2-(nonylsulfanyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCCCCCCCCSc1nc2sc3c(c2c(=O)n1c1ccccc1C)CC(OC3)(C)C
STK531969
Synonyms: 8-(butylsulfanyl)-2,2-dimethyl-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CCCCSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1
STK531970
Synonyms: ethylN-[(2Z)-2-{[(4-bromophenyl)carbonyl]amino}-3-phenylprop-2-enoyl]glycinate
Smiles: CCOC(=O)CNC(=O)/C(=C/c1ccccc1)/NC(=O)c1ccc(cc1)Br
STK531971
Synonyms: (6E)-5-imino-6-(5-nitro-2-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}benzylidene)-2-(trifluoromethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: C=CCc1ccccc1OCCOc1ccc(cc1/C=C\1/C(=O)N=c2n(C1=N)nc(s2)C(F)(F)F)[N+](=O)[O-]
STK531973
Synonyms: (2E)-2-{[1-(2-fluorobenzyl)-1H-indol-3-yl]methylidene}-N-methylhydrazinecarbothioamide
Smiles: CNC(=S)N/N=C/c1cn(c2c1cccc2)Cc1ccccc1F
STK531974
Synonyms: N-(2-{(2Z)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl}-2-oxoethyl)-3-phenylpropanamide(non-preferredname)
Smiles: O=C(N/N=C(\c1ccc(cc1)Cl)/C)CNC(=O)CCc1ccccc1
STK531975
Synonyms: 2-{8-[(diethylamino)methyl]-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}ethyl3,4,5-trimethoxybenzoate
Smiles: CCN(Cc1nc2c(n1CCOC(=O)c1cc(OC)c(c(c1)OC)OC)c(=O)n(c(=O)n2C)C)CC
STK531977
Synonyms: 2,2,5-trimethyl-8-(propan-2-yloxy)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CC(Oc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)C)C
STK531978
Synonyms: 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-phenyl-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
Smiles: Brc1ccc(cc1)C(=O)CSc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1)CCCC3
STK531979
Synonyms: 3-[1-(3-propoxybenzyl)piperidin-2-yl]pyridine
Smiles: CCCOc1cccc(c1)CN1CCCCC1c1cccnc1
STK531982
Synonyms: 1-[(3-chlorophenyl)amino]-3-methyl-2-octylpyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCCCCCCCc1c(C)c(C#N)c2n(c1Nc1cccc(c1)Cl)c1ccccc1n2
STK531983
Synonyms: 2,4-dichloro-N-(dibenzylcarbamothioyl)benzamide
Smiles: Clc1ccc(c(c1)Cl)C(=O)NC(=S)N(Cc1ccccc1)Cc1ccccc1
STK531984
Synonyms: 2-{8-[4-(3-hydroxypropyl)piperazin-1-yl]-3,7-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-1-yl}ethyl3,4,5-trimethoxybenzoate
Smiles: OCCCN1CCN(CC1)c1nc2c(n1C)c(=O)n(c(=O)n2C)CCOC(=O)c1cc(OC)c(c(c1)OC)OC
STK531986
Synonyms: 1-methyl-2-(octylsulfanyl)-1H-imidazo[4,5-c]pyridine
Smiles: CCCCCCCCSc1nc2c(n1C)ccnc2
STK531987
Synonyms: 5-oxo-2-propyl-5-(1,3-thiazol-2-ylamino)pentanoicacid
Smiles: CCCC(C(=O)O)CCC(=O)Nc1nccs1
STK531988
Synonyms: 8-ethyl-9-[(2-oxo-2-phenylethyl)sulfanyl]-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: CCn1c(SCC(=O)c2ccccc2)nc2c(c1=O)c1CCc3c(c1s2)cccc3
STK531990
Synonyms: 1-(4-chlorophenyl)-2-[(2,2-dimethyl-5-propyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl)sulfanyl]ethanone
Smiles: CCCc1nc2sc3c(c2c2c1COC(C2)(C)C)ncnc3SCC(=O)c1ccc(cc1)Cl
STK531991
Synonyms: 3-methyl-2-octyl-1-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}pyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCCCCCCCc1c(C)c(C#N)c2n(c1N1CCN(CC1)C/C=C/c1ccccc1)c1ccccc1n2
STK531992
Synonyms: 4-methoxy-N-(5-{2-[(2E)-2-(3-methylbenzylidene)hydrazinyl]-2-oxoethyl}-1,3,4-thiadiazol-2-yl)benzamide
Smiles: COc1ccc(cc1)C(=O)Nc1nnc(s1)CC(=O)N/N=C/c1cccc(c1)C
STK531995
Synonyms: N,N-dipropyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-amine
Smiles: CCCN(c1ncnc2c1c1CCCCc1s2)CCC
STK531996
Synonyms: bis[5-methyl-2-(propan-2-yl)cyclohexyl][hydroxy(phenyl)methyl]phosphonate
Smiles: CC1CCC(C(C1)OP(=O)(C(c1ccccc1)O)OC1CC(C)CCC1C(C)C)C(C)C
STK531997
Synonyms: 2,2,9-trimethyl-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8(9H)-one
Smiles: Cn1cnc2c(c1=O)sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1
STK531998
Synonyms: 3-(2,6-dichlorophenyl)-2-(4-nitrophenyl)quinazolin-4(3H)-one
Smiles: O=c1n(c(nc2c1cccc2)c1ccc(cc1)[N+](=O)[O-])c1c(Cl)cccc1Cl
STK531999
Synonyms: 3-chloro-2-{[(4-chlorophenyl)sulfanyl]methyl}imidazo[1,2-a]pyridine
Smiles: Clc1ccc(cc1)SCc1nc2n(c1Cl)cccc2
STK532000
Synonyms: 3-[(2E)-2-(3-phenoxybenzylidene)hydrazinyl]-5H-[1,2,4]triazino[5,6-b]indole
Smiles: c1ccc(cc1)Oc1cccc(c1)/C=N/Nc1nnc2c(n1)[nH]c1c2cccc1
STK532001
Synonyms: (6E)-6-{5-chloro-2-[2-(2-phenoxyethoxy)ethoxy]benzylidene}-5-imino-2-(trifluoromethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: Clc1ccc(c(c1)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)C(F)(F)F)OCCOCCOc1ccccc1
STK532002
Synonyms: dichloro{[chloro(4-methoxyphenyl)methyl](phenyl)amino}aceticacid
Smiles: COc1ccc(cc1)C(N(C(C(=O)O)(Cl)Cl)c1ccccc1)Cl
STK532003
Synonyms: bis[5-methyl-2-(propan-2-yl)cyclohexyl][(benzylamino)(phenyl)methyl]phosphonate
Smiles: CC1CCC(C(C1)OP(=O)(C(c1ccccc1)NCc1ccccc1)OC1CC(C)CCC1C(C)C)C(C)C
STK532004
Synonyms: (6E)-6-{2-[2-(4-tert-butylphenoxy)ethoxy]benzylidene}-5-imino-2-(trifluoromethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: O=C1N=c2sc(nn2C(=N)/C/1=C\c1ccccc1OCCOc1ccc(cc1)C(C)(C)C)C(F)(F)F
STK532005
Synonyms: 3-(furan-2-yl)-3-(4-methylphenyl)-N-(1,3-thiazol-2-yl)propanamide
Smiles: O=C(CC(c1ccco1)c1ccc(cc1)C)Nc1nccs1
STK532008
Synonyms: N'-[(E)-{4-[(2,4-dichlorobenzyl)oxy]phenyl}methylidene]-3-(3,5-dimethyl-1H-pyrazol-1-yl)propanehydrazide
Smiles: O=C(CCn1nc(cc1C)C)N/N=C/c1ccc(cc1)OCc1ccc(cc1Cl)Cl
STK532009
Synonyms: 4-bromo-N-(3-chloropropyl)-N-[cyano(phenyl)methyl]benzamide
Smiles: ClCCCN(C(=O)c1ccc(cc1)Br)C(c1ccccc1)C#N
STK532010
Synonyms: 8,8-dimethyl-3-(2-methylphenyl)-2-[(2-oxo-2-phenylethyl)sulfanyl]-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Smiles: Cc1ccccc1n1c(SCC(=O)c2ccccc2)nc2c(c1=O)cc1c(n2)CC(OC1)(C)C
STK532011
Synonyms: N-[5-(2-{(2E)-2-[2-(naphthalen-1-ylmethoxy)benzylidene]hydrazinyl}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]benzamide
Smiles: O=C(Cc1nnc(s1)NC(=O)c1ccccc1)N/N=C/c1ccccc1OCc1cccc2c1cccc2
STK532012
Synonyms: 6-iodo-3-(4-methoxyphenyl)-2-[(E)-2-(2-methyl-1H-indol-3-yl)ethenyl]quinazolin-4(3H)-one
Smiles: COc1ccc(cc1)n1c(/C=C/c2c(C)[nH]c3c2cccc3)nc2c(c1=O)cc(cc2)I
STK532013
Synonyms: N-benzyl-1-(2,3-dihydro-1,4-benzodioxin-2-yl)ethanamine
Smiles: CC(C1COc2c(O1)cccc2)NCc1ccccc1
STK532014
Synonyms: N'-[(3E)-5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-2-[2-(pyridin-2-yl)-1H-benzimidazol-1-yl]acetohydrazide
Smiles: O=C(Cn1c(nc2c1cccc2)c1ccccn1)N/N=C\1/C(=O)Nc2c1cc(Br)cc2
STK532015
Synonyms: pentyl2-{[(2-chlorophenyl)carbonyl]amino}-1-cyclohexyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxylate
Smiles: CCCCCOC(=O)c1c(NC(=O)c2ccccc2Cl)n(c2c1nc1ccccc1n2)C1CCCCC1
STK532018
Synonyms: 3-(5-{(E)-[2-(4-nitrophenyl)hydrazinylidene]methyl}furan-2-yl)benzoicacid
Smiles: [O-][N+](=O)c1ccc(cc1)N/N=C/c1ccc(o1)c1cccc(c1)C(=O)O
STK532019
Synonyms: N-(3'-cyano-1'H-spiro[cyclopentane-1,2'-naphthalen]-4'-yl)-2-{[3-(4-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: COc1ccc(cc1)n1c(SCC(=O)NC2=C(C#N)C3(Cc4c2cccc4)CCCC3)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
STK532020
Synonyms: N-(5-{2-[(2E)-2-{3-chloro-4-[(2-fluorobenzyl)oxy]-5-methoxybenzylidene}hydrazinyl]-2-oxoethyl}-1,3,4-thiadiazol-2-yl)-2-methylbenzamide
Smiles: COc1cc(/C=N/NC(=O)Cc2nnc(s2)NC(=O)c2ccccc2C)cc(c1OCc1ccccc1F)Cl
STK532022
Synonyms: 1-(4-bromophenyl)-2-[(2,2-dimethyl-5-propyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl)sulfanyl]ethanone
Smiles: CCCc1nc2sc3c(c2c2c1COC(C2)(C)C)ncnc3SCC(=O)c1ccc(cc1)Br
STK532023
Synonyms: 2-(5-amino-1,3,4-thiadiazol-2-yl)-N'-[(E)-{2-[(4-fluorobenzyl)oxy]phenyl}methylidene]acetohydrazide
Smiles: O=C(Cc1nnc(s1)N)N/N=C/c1ccccc1OCc1ccc(cc1)F
STK532025
Synonyms: 2-[(3,4-dichlorobenzyl)sulfanyl]-3-(2-methoxyphenyl)-6,6-dimethyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: COc1ccccc1n1c(SCc2ccc(c(c2)Cl)Cl)nc2c(c1=O)c1CC(C)(C)OCc1s2
STK532027
Synonyms: N-(5-{2-[(2Z)-2-{2-[(4-fluorobenzyl)oxy]benzylidene}hydrazinyl]-2-oxoethyl}-1,3,4-thiadiazol-2-yl)-4-methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)Nc1nnc(s1)CC(=O)N/N=C\c1ccccc1OCc1ccc(cc1)F
STK532029
Synonyms: (6E)-6-{3-ethoxy-4-[2-(2-methoxyphenoxy)ethoxy]benzylidene}-5-imino-2-(trifluoromethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCOc1cc(ccc1OCCOc1ccccc1OC)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)C(F)(F)F
STK532033
Synonyms: (6E)-6-{3-ethoxy-4-[2-(3-ethyl-5-methylphenoxy)ethoxy]benzylidene}-5-imino-2-(trifluoromethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCOc1cc(ccc1OCCOc1cc(C)cc(c1)CC)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)C(F)(F)F
STK532035
Synonyms: N-[4-chloro-2-(trifluoromethyl)phenyl]-4-[(5Z)-5-(4-ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanamide
Smiles: CCc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCCC(=O)Nc1ccc(cc1C(F)(F)F)Cl
STK532036
Synonyms: 3-[(2-methylprop-2-en-1-yl)sulfanyl]-11-phenyl-7,8,9,10-tetrahydro[1,2,4]triazolo[4'',3'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: CC(=C)CSc1nnc2n1cnc1c2sc2c1c1CCCCc1c(n2)c1ccccc1
STK532037
Synonyms: 4-[(E)-{[2-(1H-benzimidazol-2-yl)phenyl]imino}methyl]phenol
Smiles: Oc1ccc(cc1)/C=N/c1ccccc1c1nc2c([nH]1)cccc2
STK532038
Synonyms: N-ethyl-2-[3-(2-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]hydrazinecarbothioamide
Smiles: CCNC(=S)NNc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCCC3
STK532039
Synonyms: 2-methoxy-4-[(E)-{2-[(5-{[(4-methylphenyl)carbonyl]amino}-1,3,4-thiadiazol-2-yl)acetyl]hydrazinylidene}methyl]phenylbenzenesulfonate
Smiles: COc1cc(/C=N/NC(=O)Cc2nnc(s2)NC(=O)c2ccc(cc2)C)ccc1OS(=O)(=O)c1ccccc1
STK532040
Synonyms: 8-(3-methylphenyl)-9-[(2-phenylethyl)sulfanyl]-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: Cc1cccc(c1)n1c(SCCc2ccccc2)nc2c(c1=O)c1CCc3c(c1s2)cccc3
STK532041
Synonyms: 2-[(2-hydroxypropyl)sulfanyl]-3-(2-methoxyphenyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: COc1ccccc1n1c(SCC(O)C)nc2c(c1=O)c1CCCc1s2
STK532042
Synonyms: 3-bromo-2-{[(4,6-dimethylpyrimidin-2-yl)sulfanyl]methyl}-5,7-dimethylimidazo[1,2-a]pyrimidine
Smiles: Cc1nc(SCc2nc3n(c2Br)c(C)cc(n3)C)nc(c1)C
STK532043
Synonyms: 1,6-dimethyl-4-(4-methylphenyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: Cc1ccc(cc1)n1c(=O)c2c3C(C)CCCc3sc2n2c1nnc2C
STK532044
Synonyms: N-(2-{(2Z)-2-[1-(furan-2-yl)ethylidene]hydrazinyl}-2-oxoethyl)-2-phenylacetamide(non-preferredname)
Smiles: O=C(N/N=C(\c1ccco1)/C)CNC(=O)Cc1ccccc1
STK532045
Synonyms: 8-(hexylsulfanyl)-2,2-dimethyl-5-propyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CCCCCCSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)CCC
STK532046
Synonyms: ethyl2-{[4-(diethylamino)-4-oxobutanoyl]amino}-5,5-dimethyl-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CCC(=O)N(CC)CC)sc2c1CC(C)(C)OC2
STK532048
Synonyms: 8,8-dimethyl-3-(4-methylphenyl)-2-(methylsulfanyl)-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Smiles: CSc1nc2nc3CC(C)(C)OCc3cc2c(=O)n1c1ccc(cc1)C
STK532049
Synonyms: 5-methyl-3-(4-methylphenyl)-2-(methylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)C(C)CCC3
STK532050
Synonyms: 1-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-7-ethyl-4,7-dimethyl-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CCC1(C)OCc2c(C1)c1c(s2)n2c(SCC(=O)c3ccc(cc3)Cl)nnc2n(c1=O)C
STK532051
Synonyms: 2-(heptylsulfanyl)-3-(2-methylphenyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCCCCCCSc1nc2sc3c(c2c(=O)n1c1ccccc1C)CCC3
STK532053
Synonyms: 2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-8,8-dimethyl-3-(4-methylphenyl)-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Smiles: Cc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)Cl)nc2c(c1=O)cc1c(n2)CC(OC1)(C)C
STK532054
Synonyms: 8-butoxy-5-(propan-2-yl)-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: CCCCOc1ncnc2c1sc1c2c2CCCCc2c(n1)C(C)C
STK532055
Synonyms: cobalt(2+)bis[N-(4-ethoxyphenyl)-1,3-benzothiazole-2-carbimidothioate]
Smiles: CCOc1ccc(cc1)/N=C(\c1nc2c(s1)cccc2)/S[Co]S/C(=N/c1ccc(cc1)OCC)/c1nc2c(s1)cccc2
STK532057
Synonyms: N-{(1Z)-3-(cyclohexylamino)-1-[5-(3-nitrophenyl)furan-2-yl]-3-oxoprop-1-en-2-yl}-4-methoxybenzamide
Smiles: COc1ccc(cc1)C(=O)N/C(=C\c1ccc(o1)c1cccc(c1)[N+](=O)[O-])/C(=O)NC1CCCCC1
STK532058
Synonyms: (2E)-4-{[3-(ethoxycarbonyl)-5-(propan-2-yl)-4,7-dihydro-5H-thieno[2,3-c]pyran-2-yl]amino}-4-oxobut-2-enoicacid
Smiles: CCOC(=O)c1c(NC(=O)/C=C/C(=O)O)sc2c1CC(OC2)C(C)C
STK532059
Synonyms: 5-methyl-N,N-dipropyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-amine
Smiles: CCCN(c1ncnc2c1sc1c2c2CCCCc2c(n1)C)CCC
STK532060
Synonyms: N'-(2,2-dimethyl-5-phenyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl)-N,N-dimethylethane-1,2-diamine
Smiles: CN(CCNc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)c1ccccc1)C
STK532062
Synonyms: 3-[(Z)-(5-imino-7-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl]phenyl4-methylbenzenesulfonate
Smiles: CCCc1nn2c(=NC(=O)/C(=C\c3cccc(c3)OS(=O)(=O)c3ccc(cc3)C)/C2=N)s1
STK532063
Synonyms: bis(2-methylpropyl)[hydroxy(4-methoxyphenyl)methyl]phosphonate
Smiles: COc1ccc(cc1)C(P(=O)(OCC(C)C)OCC(C)C)O
STK532064
Synonyms: N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-N-methylbutan-1-amine
Smiles: CCCCN(CC1OCc2c(CO1)cccc2)C
STK532065
Synonyms: 2-methoxy-4-[(Z)-{2-[(5-{[(4-methylphenyl)carbonyl]amino}-1,3,4-thiadiazol-2-yl)acetyl]hydrazinylidene}methyl]phenyl4-chlorobenzoate
Smiles: COc1cc(/C=N\NC(=O)Cc2nnc(s2)NC(=O)c2ccc(cc2)C)ccc1OC(=O)c1ccc(cc1)Cl
STK532066
Synonyms: 1-(benzylsulfanyl)-8-tert-butyl-4-(2-methylphenyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: O=c1c2c3CCC(Cc3sc2n2c(n1c1ccccc1C)nnc2SCc1ccccc1)C(C)(C)C
STK532067
Synonyms: 2-hydrazinyl-3-(2-methylphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: NNc1nc2c3ccccc3CC3(c2c(=O)n1c1ccccc1C)CCCCC3
STK532068
Synonyms: 3-(2-methylphenyl)-2-(prop-2-en-1-ylsulfanyl)-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one
Smiles: C=CCSc1nc2nc3CCCCc3cc2c(=O)n1c1ccccc1C
STK532069
Synonyms: 4-(tricyclo[4.3.1.1~3,8~]undec-1-ylmethyl)morpholine
Smiles: O1CCN(CC1)CC12CC3CCC(C1)CC(C2)C3
STK532070
Synonyms: 4-(3-bromophenyl)-1,8-dichloro-2-[(2-nitrophenyl)sulfanyl]-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline
Smiles: Clc1ccc2c(c1)C1C(Cl)C(CC1C(N2)c1cccc(c1)Br)Sc1ccccc1[N+](=O)[O-]
STK532071
Synonyms: 3-(4-methylphenyl)-6-(propan-2-yl)-2-(propylsulfanyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCCSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CC(OC3)C(C)C
STK532074
Synonyms: N-(4-bromophenyl)-4-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)benzamide
Smiles: O=C(c1ccc(cc1)N1C(=O)C2C(C1=O)C1CC2C=C1)Nc1ccc(cc1)Br
STK532075
Synonyms: 2-[(1-imino-9,9-dimethyl-2,5-diphenyl-6-thioxo-2,5,6,7,9,10-hexahydro-1H-pyrano[4',3':4,5]pyrido[2,3-d]pyrimidin-3-yl)sulfanyl]-N-(2-nitrophenyl)acetamide
Smiles: O=C(Nc1ccccc1[N+](=O)[O-])CSc1nc2c(c(=N)n1c1ccccc1)c1CC(C)(C)OCc1c(=S)n2c1ccccc1
STK532076
Synonyms: 7-tert-butyl-4-chloro-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
Smiles: Clc1ncnc2c1c1CCC(Cc1s2)C(C)(C)C
STK532077
Synonyms: 9-(butylsulfanyl)-8-(2-methoxyphenyl)-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: CCCCSc1nc2sc3c(c2c(=O)n1c1ccccc1OC)CCc1c3cccc1
STK532078
Synonyms: N-(5-{2-[(2E)-2-{5-chloro-2-[2-(3-methylphenoxy)ethoxy]benzylidene}hydrazinyl]-2-oxoethyl}-1,3,4-thiadiazol-2-yl)-2-methylbenzamide
Smiles: O=C(Cc1nnc(s1)NC(=O)c1ccccc1C)N/N=C/c1cc(Cl)ccc1OCCOc1cccc(c1)C
STK532079
Synonyms: N'-[(2,4-dichlorophenyl)carbonyl]-2-oxo-8-(prop-2-en-1-yl)-2H-chromene-3-carbohydrazide
Smiles: C=CCc1cccc2c1oc(=O)c(c2)C(=O)NNC(=O)c1ccc(cc1Cl)Cl
STK532080
Synonyms: ethyl5,5-dimethyl-2-{[N-(2-phenylethyl)glycyl]amino}-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CNCCc2ccccc2)sc2c1CC(C)(C)OC2
STK532081
Synonyms: 2-{[2,2-dimethyl-5-(morpholin-4-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]sulfanyl}-1-(4-fluorophenyl)ethanone
Smiles: Fc1ccc(cc1)C(=O)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)N1CCOCC1
STK532083
Synonyms: 1-methyl-4-(4-methylphenyl)-7-(propan-2-yl)-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CC(C1OCc2c(C1)c1c(=O)n(c3ccc(cc3)C)c3n(c1s2)c(C)nn3)C
STK532084
Synonyms: 5,7-diethyl-2-[4-(prop-2-en-1-yloxy)phenyl]-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Smiles: CCC12CN3CC(C2=O)(CN(C1)C3c1ccc(cc1)OCC=C)CC
STK532085
Synonyms: 4-{[(2,2-dimethyltetrahydro-2H-pyran-4-yl)amino]methyl}-2-methoxyphenol
Smiles: COc1cc(CNC2CCOC(C2)(C)C)ccc1O
STK532086
Synonyms: 5,7-di(propan-2-yl)-2-[4-(prop-2-en-1-yloxy)phenyl]-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Smiles: C=CCOc1ccc(cc1)C1N2CC3(CN1CC(C2)(C3=O)C(C)C)C(C)C
STK532087
Synonyms: methyl2-{[4-amino-6-(propan-2-yl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}propanoate
Smiles: COC(=O)C(Sc1nc(N)c2c(n1)sc1c2CC(OC1)C(C)C)C
STK532088
Synonyms: 3-phenyl-2-[(2-phenylethyl)sulfanyl]-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CC(C1OCc2c(C1)c1c(s2)nc(n(c1=O)c1ccccc1)SCCc1ccccc1)C
STK532090
Synonyms: 1-[(2-oxo-2-phenylethyl)sulfanyl]-4-phenyl-7-(propan-2-yl)-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CC(C1OCc2c(C1)c1c(s2)n2c(SCC(=O)c3ccccc3)nnc2n(c1=O)c1ccccc1)C
STK532091
Synonyms: N-methyl-2-[3-(4-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]hydrazinecarbothioamide
Smiles: CNC(=S)NNc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)C)CCCCC3
STK532092
Synonyms: 2-(undec-10-enoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: C=CCCCCCCCCC(=O)Nc1sc2c(c1C(=O)N)CCCC2
STK532093
Synonyms: 8-methoxy-5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinoline
Smiles: CCCc1nc2sc3c(c2c2c1CCCC2)ncnc3OC
STK532094
Synonyms: (6E)-5-imino-6-[(1-{2-[2-methoxy-4-(prop-2-en-1-yl)phenoxy]ethyl}-2-methyl-1H-indol-3-yl)methylidene]-2-propyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCCc1nn2c(=NC(=O)/C(=C/c3c(C)n(c4c3cccc4)CCOc3ccc(cc3OC)CC=C)/C2=N)s1
STK532095
Synonyms: (5Z)-1-(3,4-dimethylphenyl)-5-(2,4,5-trimethoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1cc(OC)c(cc1/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(c(c1)C)C)OC
STK532098
Synonyms: 3-bromo-N-(2-{(2E)-2-[1-(furan-2-yl)ethylidene]hydrazinyl}-2-oxoethyl)benzamide(non-preferredname)
Smiles: O=C(N/N=C(/c1ccco1)\C)CNC(=O)c1cccc(c1)Br
STK532101
Synonyms: 3-(2,6-dichlorophenyl)-2-phenylquinazolin-4(3H)-one
Smiles: Clc1cccc(c1n1c(nc2c(c1=O)cccc2)c1ccccc1)Cl
STK532102
Synonyms: 3-({4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}carbonyl)-2H-chromen-2-one
Smiles: O=c1oc2ccccc2cc1C(=O)N1CCN(CC1)C/C=C/c1ccccc1
STK532103
Synonyms: (6Z)-6-({1-[2-(4-chlorophenoxy)ethyl]-2-methyl-1H-indol-3-yl}methylidene)-5-imino-2-(trifluoromethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: Clc1ccc(cc1)OCCn1c2ccccc2c(c1C)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)C(F)(F)F
STK532104
Synonyms: ethyl{[5-methyl-3-(4-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetate
Smiles: CCOC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)C(C)CCC3
STK532105
Synonyms: 3,4,5-trimethoxy-N-{2-oxo-2-[(2E)-2-(1-phenylpropan-2-ylidene)hydrazinyl]ethyl}benzamide(non-preferredname)
Smiles: COc1cc(cc(c1OC)OC)C(=O)NCC(=O)N/N=C(/Cc1ccccc1)\C
STK532106
Synonyms: N'-[(1E)-1-(2,3-dihydro-1,4-benzodioxin-2-yl)ethylidene]-2,3-dihydro-1,4-benzodioxine-2-carbohydrazide
Smiles: O=C(C1COc2c(O1)cccc2)N/N=C(/C1COc2c(O1)cccc2)\C
STK532110
Synonyms: 2-(butylsulfanyl)-3-(2-methoxyphenyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCCCSc1nc2sc3c(c2c(=O)n1c1ccccc1OC)CCC3
STK532113
Synonyms: 7-methyl-2-[(4-methylphenyl)amino]-3-{(E)-[(4-methylphenyl)imino]methyl}-4H-pyrido[1,2-a]pyrimidin-4-one
Smiles: Cc1ccc(cc1)/N=C/c1c(Nc2ccc(cc2)C)nc2n(c1=O)cc(cc2)C
STK532114
Synonyms: 9-(benzylsulfanyl)-8-cyclohexyl-5,8-dihydronaphtho[2',1':4,5]thieno[2,3-d]pyrimidin-7(6H)-one
Smiles: O=c1c2c(sc3c2CCc2c3cccc2)nc(n1C1CCCCC1)SCc1ccccc1
STK532116
Synonyms: 1-(4-bromophenyl)-2-{[2,2-dimethyl-5-(propan-2-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]sulfanyl}ethanone
Smiles: Brc1ccc(cc1)C(=O)CSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)C(C)C
STK532117
Synonyms: N-({2-[3-(2-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]hydrazinyl}carbonothioyl)benzamide
Smiles: COc1ccccc1n1c(NNC(=S)NC(=O)c2ccccc2)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
STK532118
Synonyms: 2-(5-amino-1,3,4-thiadiazol-2-yl)-N'-{(Z)-[3-(benzyloxy)phenyl]methylidene}acetohydrazide
Smiles: O=C(Cc1nnc(s1)N)N/N=C\c1cccc(c1)OCc1ccccc1
STK532120
Synonyms: 4,4'-[oxybis(3-phenylquinoxaline-7,2-diyl)]diphenol
Smiles: Oc1ccc(cc1)c1nc2cc(ccc2nc1c1ccccc1)Oc1ccc2c(c1)nc(c(n2)c1ccccc1)c1ccc(cc1)O
STK532121
Synonyms: 4-(3-methoxyphenyl)-1-[(2-phenylethyl)sulfanyl]-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Smiles: COc1cccc(c1)n1c2nnc(n2c2c(c1=O)C1(CCCCC1)Cc1c2cccc1)SCCc1ccccc1
STK532123
Synonyms: N'-[(E)-(2-methyl-1H-indol-3-yl)methylidene]-2-[2-(pyridin-2-yl)-1H-benzimidazol-1-yl]acetohydrazide
Smiles: O=C(Cn1c(nc2c1cccc2)c1ccccn1)N/N=C/c1c(C)[nH]c2c1cccc2
STK532124
Synonyms: (2E)-2-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-1,1-diphenylhydrazine
Smiles: [O-][N+](=O)c1cccc(c1)c1ccc(o1)/C=N/N(c1ccccc1)c1ccccc1
STK532125
Synonyms: N'-[(1E)-1-(3,4-dimethoxyphenyl)ethylidene]-3-(3,5-dimethyl-1H-pyrazol-1-yl)propanehydrazide
Smiles: COc1cc(ccc1OC)/C(=N/NC(=O)CCn1nc(cc1C)C)/C
STK532126
Synonyms: N'-[(E)-(4-chloro-3-nitrophenyl)methylidene]-3-(3,5-dimethyl-1H-pyrazol-1-yl)propanehydrazide
Smiles: O=C(CCn1nc(cc1C)C)N/N=C/c1ccc(c(c1)[N+](=O)[O-])Cl
STK532127
Synonyms: 2-(5-amino-1,3,4-thiadiazol-2-yl)-N'-[(E)-(3-chloro-5-methoxy-4-{2-[2-(4-methylphenoxy)ethoxy]ethoxy}phenyl)methylidene]acetohydrazide
Smiles: COc1cc(/C=N/NC(=O)Cc2nnc(s2)N)cc(c1OCCOCCOc1ccc(cc1)C)Cl
STK532128
Synonyms: 3-(2-methoxyphenyl)-2-[(3-{[3-(4-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}propyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: COc1ccc(cc1)n1c(SCCCSc2nc3c4ccccc4CC4(c3c(=O)n2c2ccccc2OC)CCCCC4)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
STK532129
Synonyms: 2-(benzylsulfanyl)-3-(furan-2-ylmethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: O=c1n(Cc2ccco2)c(SCc2ccccc2)nc2c1C1(CCCCC1)Cc1c2cccc1
STK532130
Synonyms: N-[(1-phenylcyclopentyl)methyl]-2-(piperidin-1-yl)propanamide
Smiles: O=C(C(N1CCCCC1)C)NCC1(CCCC1)c1ccccc1
STK532131
Synonyms: 1-(4-methylphenyl)-N,4-diphenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carbothioamide
Smiles: Cc1ccc(cc1)c1c2CCCCn3c2n(c1C(=S)Nc1ccccc1)cc3c1ccccc1
STK532132
Synonyms: 1-(heptylsulfanyl)-4-(2-methylphenyl)-6,7,8,9-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: CCCCCCCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1C)CCCC3
STK532133
Synonyms: 1-[(4-fluorophenyl)amino]-3-methyl-2-octylpyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCCCCCCCc1c(C)c(C#N)c2n(c1Nc1ccc(cc1)F)c1ccccc1n2
STK532138
Synonyms: N'-[(1E)-1-(2,3-dihydro-1,4-benzodioxin-2-yl)ethylidene]acetohydrazide
Smiles: CC(=O)N/N=C(/C1COc2c(O1)cccc2)\C
STK532139
Synonyms: ethyl[(5-propyl-1,2,3,4-tetrahydropyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-8-yl)sulfanyl]acetate
Smiles: CCOC(=O)CSc1ncnc2c1sc1c2c2CCCCc2c(n1)CCC
STK532140
Synonyms: 2-(butylsulfanyl)-3-(furan-2-ylmethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: CCCCSc1nc2c3ccccc3CC3(c2c(=O)n1Cc1ccco1)CCCCC3
STK532141
Synonyms: (2E)-2-{[1-(4-fluorobenzyl)-1H-indol-3-yl]methylidene}-N-methylhydrazinecarbothioamide
Smiles: CNC(=S)N/N=C/c1cn(c2c1cccc2)Cc1ccc(cc1)F
STK532142
Synonyms: N-(2-{(2E)-2-[1-(2,4-dimethoxyphenyl)ethylidene]hydrazinyl}-2-oxoethyl)-2-fluorobenzamide(non-preferredname)
Smiles: COc1cc(OC)ccc1/C(=N/NC(=O)CNC(=O)c1ccccc1F)/C
STK532143
Synonyms: 5-methyl-3-(4-methylphenyl)-2-(pentylsulfanyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CCCCCSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)C(C)CCC3
STK532144
Synonyms: 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-(4-methoxyphenyl)-7-methyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)Br)nc2c(c1=O)c1CCC(Cc1s2)C
STK532145
Synonyms: 3-(4-methoxyphenyl)-2-[(3-{[3-(2-methylphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}propyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: COc1ccc(cc1)n1c(SCCCSc2nc3c4ccccc4CC4(c3c(=O)n2c2ccccc2C)CCCCC4)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
STK532146
Synonyms: 2-[(2E)-2-(1,3-benzodioxol-5-ylmethylidene)hydrazinyl]-3-(3-methoxyphenyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: COc1cccc(c1)n1c(N/N=C/c2ccc3c(c2)OCO3)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
STK532147
Synonyms: 2-bromo-N'-[3-(3-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]benzohydrazide
Smiles: COc1cccc(c1)n1c(NNC(=O)c2ccccc2Br)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
STK532148
Synonyms: (2E)-N-ethyl-2-{[1-(2-fluorobenzyl)-1H-indol-3-yl]methylidene}hydrazinecarbothioamide
Smiles: CCNC(=S)N/N=C/c1cn(c2c1cccc2)Cc1ccccc1F
STK532149
Synonyms: 8-[(3,4-dichlorobenzyl)sulfanyl]-2,2-dimethyl-5-(propan-2-yl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CC(c1nc2sc3c(c2c2c1COC(C2)(C)C)ncnc3SCc1ccc(c(c1)Cl)Cl)C
STK532151
Synonyms: N-(4-methylphenyl)-2-[(5-oxo-4-phenyl-4,5,7,8-tetrahydro-6H-cyclopenta[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc(cc1)C)CSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CCC3
STK532152
Synonyms: 2-[(E)-2-(1-benzyl-1H-indol-3-yl)ethenyl]-3-ethyl-6-iodoquinazolin-4(3H)-one
Smiles: CCn1c(/C=C/c2cn(c3c2cccc3)Cc2ccccc2)nc2c(c1=O)cc(cc2)I
STK532153
Synonyms: 1,6-bis(4-butoxyphenyl)-2,5-bis[(dipropylamino)methyl]hexane-1,6-dione
Smiles: CCCN(CC(C(=O)c1ccc(cc1)OCCCC)CCC(C(=O)c1ccc(cc1)OCCCC)CN(CCC)CCC)CCC
STK532155
Synonyms: 3-(2,6-dichlorophenyl)-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4(3H)-one
Smiles: O=c1n(c(/C=C/c2ccc(cc2)[N+](=O)[O-])nc2c1cccc2)c1c(Cl)cccc1Cl
STK532156
Synonyms: 4-chloro-N-{2-oxo-2-[(2E)-2-(1-phenylpropan-2-ylidene)hydrazinyl]ethyl}benzamide(non-preferredname)
Smiles: O=C(N/N=C(/Cc1ccccc1)\C)CNC(=O)c1ccc(cc1)Cl
STK532157
Synonyms: 5,5'-[(2,4-dichlorophenyl)methanediyl]dipyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)C(C(=O)N1)C(c1ccc(cc1Cl)Cl)C1C(=O)NC(=O)NC1=O
STK532160
Synonyms: 2-(heptylsulfanyl)-3-phenyl-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCCCCCCSc1nc2sc3c(c2c(=O)n1c1ccccc1)CC(OC3)C(C)C
STK532161
Synonyms: 6-ethyl-6-methyl-2-[(naphthalen-1-ylmethyl)sulfanyl]-3-phenyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCC1(C)OCc2c(C1)c1c(s2)nc(n(c1=O)c1ccccc1)SCc1cccc2c1cccc2
STK532162
Synonyms: 6,8-dibromo-N-(4-ethylphenyl)-2-oxo-2H-chromene-3-carboxamide
Smiles: CCc1ccc(cc1)NC(=O)c1cc2cc(Br)cc(c2oc1=O)Br
STK532163
Synonyms: (6E)-5-imino-6-[(1-{2-[5-methyl-2-(propan-2-yl)phenoxy]ethyl}-1H-indol-3-yl)methylidene]-2-propyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCCc1nn2c(=NC(=O)/C(=C/c3cn(c4c3cccc4)CCOc3cc(C)ccc3C(C)C)/C2=N)s1
STK532164
Synonyms: N-(2-methoxyphenyl)-2-{[7-methyl-3-(4-methylphenyl)-4-oxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Smiles: COc1ccccc1NC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)C)CCN(C3)C
STK532165
Synonyms: 3-(furan-2-yl)-3-phenyl-N-(1,3-thiazol-2-yl)propanamide
Smiles: O=C(CC(c1ccco1)c1ccccc1)Nc1nccs1
STK532166
Synonyms: 2,2'-{[6-(diethylamino)-1,3,5-triazine-2,4-diyl]diimino}diaceticacid(non-preferredname)
Smiles: CCN(c1nc(NCC(=O)O)nc(n1)NCC(=O)O)CC
STK532168
Synonyms: 2-[(Z)-(5-bromo-1-methyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-3-ethyl-6-iodoquinazolin-4(3H)-one
Smiles: CCn1c(/C=C\2/c3cc(Br)ccc3N(C2=O)C)nc2c(c1=O)cc(cc2)I
STK532169
Synonyms: benzylN-[(2Z)-2-{[(4-bromophenyl)carbonyl]amino}-3-phenylprop-2-enoyl]leucinate
Smiles: CC(CC(C(=O)OCc1ccccc1)NC(=O)/C(=C/c1ccccc1)/NC(=O)c1ccc(cc1)Br)C
STK532170
Synonyms: 2-[3-(4-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]-N-(prop-2-en-1-yl)hydrazinecarbothioamide
Smiles: C=CCNC(=S)NNc1nc2c3ccccc3CC3(c2c(=O)n1c1ccc(cc1)OC)CCCCC3
STK532172
Synonyms: 2,4-dichloro-N-[4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,3-thiazol-2-yl]benzamide
Smiles: Clc1ccc(c(c1)Cl)C(=O)Nc1scc(n1)C12CC3CC(C2)CC(C1)C3
STK532173
Synonyms: 3-methyl-1-{[4-(nonyloxy)phenyl]amino}pyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCCCCCCCCOc1ccc(cc1)Nc1cc(C)c(c2n1c1ccccc1n2)C#N
STK532175
Synonyms: 2-[3,7-dimethyl-8-(4-methylpiperazin-1-yl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-1-yl]ethyl3,4,5-trimethoxybenzoate
Smiles: COc1c(OC)cc(cc1OC)C(=O)OCCn1c(=O)c2n(C)c(nc2n(c1=O)C)N1CCN(CC1)C
STK532176
Synonyms: N'-[(E)-{1-[2-(3-methylphenoxy)ethyl]-1H-indol-3-yl}methylidene]pyridine-4-carbohydrazide
Smiles: Cc1cccc(c1)OCCn1cc(c2c1cccc2)/C=N/NC(=O)c1ccncc1
STK532177
Synonyms: 2-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-8,8-dimethyl-3-(2-methylphenyl)-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Smiles: O=c1n(c(SCc2ccc3c(c2)OCO3)nc2c1cc1COC(Cc1n2)(C)C)c1ccccc1C
STK532178
Synonyms: 2-(benzylsulfanyl)-5-methyl-3-phenyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: CC1CCCc2c1c1c(s2)nc(n(c1=O)c1ccccc1)SCc1ccccc1
STK532179
Synonyms: 2-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-3-(4-methylphenyl)quinazolin-4(3H)-one
Smiles: C/C(=C/CSc1nc2ccccc2c(=O)n1c1ccc(cc1)C)/Cl
STK532180
Synonyms: N'-[(2,4-dichlorophenyl)carbonyl]-2-oxo-2H-chromene-3-carbohydrazide
Smiles: Clc1ccc(c(c1)Cl)C(=O)NNC(=O)c1cc2ccccc2oc1=O
STK532181
Synonyms: 2-(hexylsulfanyl)-3-(2-methylphenyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCCCCCSc1nc2sc3c(c2c(=O)n1c1ccccc1C)CCC3
STK532182
Synonyms: 2-[(2-oxo-2-phenylethyl)sulfanyl]-3-phenyl-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CC(C1OCc2c(C1)c1c(s2)nc(n(c1=O)c1ccccc1)SCC(=O)c1ccccc1)C
STK532183
Synonyms: 2-[(2,2-dimethyl-5-propyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl)sulfanyl]-1-phenylethanone
Smiles: CCCc1nc2sc3c(c2c2c1COC(C2)(C)C)ncnc3SCC(=O)c1ccccc1
STK532184
Synonyms: 8-ethyl-8-methyl-3-phenyl-2-(prop-2-en-1-ylsulfanyl)-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Smiles: C=CCSc1nc2nc3CC(C)(CC)OCc3cc2c(=O)n1c1ccccc1
STK532185
Synonyms: 2-{[(6-chloroimidazo[1,2-a]pyridin-2-yl)methyl]sulfanyl}-5-nitro-1H-benzimidazole
Smiles: Clc1ccc2n(c1)cc(n2)CSc1nc2c([nH]1)ccc(c2)[N+](=O)[O-]
STK532186
Synonyms: 3-(2-methylphenyl)-2-(2-methylpropyl)quinazolin-4(3H)-one
Smiles: CC(Cc1nc2ccccc2c(=O)n1c1ccccc1C)C
STK532187
Synonyms: 7-cyclohexyl-3-(piperidin-1-yl)-1-(prop-2-en-1-ylamino)-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carbonitrile
Smiles: C=CCNc1nc(N2CCCCC2)c(c2c1CN(CC2)C1CCCCC1)C#N
STK532188
Synonyms: (bis{[5-methyl-2-(propan-2-yl)cyclohexyl]oxy}phosphoryl)(pyridin-3-yl)methylbenzoate
Smiles: CC1CCC(C(C1)OP(=O)(C(c1cccnc1)OC(=O)c1ccccc1)OC1CC(C)CCC1C(C)C)C(C)C
STK532189
Synonyms: 1-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-4-(3-methoxyphenyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one
Smiles: COc1cccc(c1)n1c2nnc(n2c2c(c1=O)C1(CCCCC1)Cc1c2cccc1)SCC(=O)c1ccc(cc1)Br
STK532190
Synonyms: 2-benzyl-1-(hexadecylamino)-3-methylpyrido[1,2-a]benzimidazole-4-carbonitrile
Smiles: CCCCCCCCCCCCCCCCNc1c(Cc2ccccc2)c(C)c(c2n1c1ccccc1n2)C#N
STK532192
Synonyms: 3-(3-bromophenyl)-2-[(2,4-dimethylbenzyl)sulfanyl]-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-4(6H)-one
Smiles: Brc1cccc(c1)n1c(SCc2ccc(cc2C)C)nc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
STK532193
Synonyms: 2-[(Z)-(5-bromo-2-oxo-1-propyl-1,2-dihydro-3H-indol-3-ylidene)methyl]-3-ethyl-6-iodoquinazolin-4(3H)-one
Smiles: CCCN1C(=O)/C(=C\c2nc3ccc(cc3c(=O)n2CC)I)/c2c1ccc(c2)Br
STK532196
Synonyms: N-(3'-cyano-1'H-spiro[cyclopentane-1,2'-naphthalen]-4'-yl)-2-{[3-(2-methoxyphenyl)-4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-2-yl]sulfanyl}acetamide
Smiles: N#CC1=C(NC(=O)CSc2nc3c4ccccc4CC4(c3c(=O)n2c2ccccc2OC)CCCCC4)c2ccccc2CC21CCCC2
STK532197
Synonyms: (6E)-6-({1-[2-(2-chlorophenoxy)ethyl]-2-methyl-1H-indol-3-yl}methylidene)-5-imino-2-(trifluoromethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: O=C1N=c2sc(nn2C(=N)/C/1=C\c1c(C)n(c2c1cccc2)CCOc1ccccc1Cl)C(F)(F)F
STK532198
Synonyms: 2-(1H-benzimidazol-2-yl)-N-[(E)-pyridin-3-ylmethylidene]aniline
Smiles: c1ccc(cn1)/C=N/c1ccccc1c1nc2c([nH]1)cccc2
STK532199
Synonyms: 5-methyl-2-(propan-2-yl)cyclohexyl[1,3-benzodioxol-5-yl(hydroxy)methyl][4-(dimethylamino)phenyl]phosphinate
Smiles: CC1CCC(C(C1)OP(=O)(C(c1ccc2c(c1)OCO2)O)c1ccc(cc1)N(C)C)C(C)C
STK532200
Synonyms: 5-(furan-2-yl)-8-(heptylsulfanyl)-2,2-dimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Smiles: CCCCCCCSc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)c1ccco1
STK532201
Synonyms: N-(5-{2-[(2E)-2-(4-methylbenzylidene)hydrazinyl]-2-oxoethyl}-1,3,4-thiadiazol-2-yl)benzamide
Smiles: O=C(Cc1nnc(s1)NC(=O)c1ccccc1)N/N=C/c1ccc(cc1)C
STK532203
Synonyms: N'-[2,2-dimethyl-5-(2-methylpropyl)-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]-N,N-diethylethane-1,2-diamine
Smiles: CCN(CCNc1ncnc2c1sc1c2c2CC(C)(C)OCc2c(n1)CC(C)C)CC