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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STK527988
Synonyms: N-dodecyl-1-ethyl-6-fluoro-7-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CCCCCCCCCCCCNC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C(=O)c1ccco1)F
STK527990
Synonyms: dipropan-2-yl{(1Z)-1-[2-(4-nitrophenyl)hydrazinylidene]-2-oxoethyl}phosphonate
Smiles: O=C/C(=N/Nc1ccc(cc1)[N+](=O)[O-])/P(=O)(OC(C)C)OC(C)C
STK527992
Synonyms: 8-methoxy-3-{[(E)-(3-nitrophenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cccc(c1)[N+](=O)[O-]
STK527993
Synonyms: 2-[bis(5-methylfuran-2-yl)methyl]-6-bromo-4-nitrophenol
Smiles: Cc1ccc(o1)C(c1cc(cc(c1O)Br)[N+](=O)[O-])c1ccc(o1)C
STK527996
Synonyms: 1-[5-(bromomethyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-yl]-3-(3-chlorophenyl)-1-(4-methylphenyl)urea
Smiles: BrCC1(C)CN=C(S1)N(C(=O)Nc1cccc(c1)Cl)c1ccc(cc1)C
STK527997
Synonyms: ethyl2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-3,3,3-trifluoro-N-(pyridin-3-ylcarbonyl)alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(NC(=O)c1cccnc1)Nc1nc2c(s1)cc(cc2)OCC
STK527998
Synonyms: 8-methyl-3-{[(E)-(3-nitrophenyl)methylidene]amino}-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: Cc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1cccc(c1)[N+](=O)[O-]
STK527999
Synonyms: 2-[bis(5-methylfuran-2-yl)methyl]-4-bromo-6-nitrophenol
Smiles: Brc1cc(C(c2ccc(o2)C)c2ccc(o2)C)c(c(c1)[N+](=O)[O-])O
STK528001
Synonyms: 8-methoxy-3-({(E)-[4-(pentyloxy)phenyl]methylidene}amino)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: CCCCCOc1ccc(cc1)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)OC
STK528002
Synonyms: 1-[{[dimethyl(oxido)-lambda~6~-sulfanylidene]amino}(diphenyl)-lambda~5~-phosphanylidene]-1-[(E)-phenyldiazenyl]propan-2-one
Smiles: CC(=O)C(=P(c1ccccc1)(c1ccccc1)N=S(=O)(C)C)/N=N/c1ccccc1
STK528007
Synonyms: 4-[2-amino-3-cyano-4,4-bis(trifluoromethyl)-5,6,7,8-tetrahydroquinolin-1(4H)-yl]-N-(pyrimidin-2-yl)benzenesulfonamide
Smiles: N#CC1=C(N)N(c2ccc(cc2)S(=O)(=O)Nc2ncccn2)C2=C(C1(C(F)(F)F)C(F)(F)F)CCCC2
STK528008
Synonyms: (1,2,2-trimethylcyclopentane-1,3-diyl)bis(morpholin-4-ylmethanone)
Smiles: O=C(C1CCC(C1(C)C)(C)C(=O)N1CCOCC1)N1CCOCC1
STK528009
Synonyms: 2-(4-bromophenyl)-1-[2-(piperidin-1-yl)ethyl]-1H-imidazo[1,2-a]benzimidazole
Smiles: Brc1ccc(cc1)c1cn2c(n1CCN1CCCCC1)nc1c2cccc1
STK528011
Synonyms: methyl5-chloro-3-{[(4-oxopiperidin-1-yl)acetyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCC(=O)CC1)cc(cc2)Cl
STK528012
Synonyms: N-(2,2-dimethylpropanoyl)glycylnorvaline
Smiles: CCCC(C(=O)O)NC(=O)CNC(=O)C(C)(C)C
STK528013
Synonyms: 2-(azepan-1-yl)-3-(3,5-dimethyl-1H-pyrazol-1-yl)quinoxaline
Smiles: Cc1nn(c(c1)C)c1nc2ccccc2nc1N1CCCCCC1
STK528014
Synonyms: N-[2-(diethylamino)ethyl]-1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CCN(CCNC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C)F)CC
STK528015
Synonyms: 4-[(E)-{2-[2-(2,4-dichlorophenyl)quinazolin-4-yl]hydrazinylidene}methyl]-2-methylbenzene-1,3-diol
Smiles: Clc1ccc(c(c1)Cl)c1nc(N/N=C/c2ccc(c(c2O)C)O)c2c(n1)cccc2
STK528016
Synonyms: 4-(isoquinolinium-2-yl)-2-oxo-5-{(E)-[2-(phenylcarbonyl)hydrazinylidene]methyl}-1,3-thiazol-3-ide
Smiles: O=c1[n-]c(c(s1)/C=N/NC(=O)c1ccccc1)[n+]1ccc2c(c1)cccc2
STK528019
Synonyms: 5-[1-(phenylamino)ethylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CC(=C1C(=O)NC(=O)NC1=O)Nc1ccccc1
STK528021
Synonyms: ethyl5-fluoro-3-{[(4-methylpiperidin-1-yl)acetyl]amino}-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCC(CC1)C)cc(cc2)F
STK528022
Synonyms: 1-methyl-2-tridecyl-1H-imidazo[4,5-c]pyridine
Smiles: CCCCCCCCCCCCCc1nc2c(n1C)ccnc2
STK528023
Synonyms: 8-(heptylsulfanyl)-3-methyl-7-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCSc1nc2c(n1CCC(C)C)c(=O)[nH]c(=O)n2C
STK528027
Synonyms: 4-[(E)-{2-[2-(2-chlorophenyl)quinazolin-4-yl]hydrazinylidene}methyl]benzene-1,3-diol
Smiles: Oc1ccc(c(c1)O)/C=N/Nc1nc(nc2c1cccc2)c1ccccc1Cl
STK528029
Synonyms: 8-methyl-4-(pyrrolidin-1-yl)-5H-pyrimido[5,4-b]indole
Smiles: Cc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCCC1
STK528031
Synonyms: 6,7-dimethoxy-3-[(3-methoxyphenyl)amino]-2-benzofuran-1(3H)-one
Smiles: COc1cccc(c1)NC1OC(=O)c2c1ccc(c2OC)OC
STK528032
Synonyms: 7-benzyl-8-(heptylsulfanyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCSc1nc2c(n1Cc1ccccc1)c(=O)[nH]c(=O)n2C
STK528034
Synonyms: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(1H-indol-3-yl)ethanol
Smiles: OC(c1c[nH]c2c1cccc2)CN1CCN(CC1)Cc1ccc2c(c1)OCO2
STK528035
Synonyms: 1,4-diethyl-3,6-bis(morpholin-4-ylmethyl)tetrahydroimidazo[4,5-d]imidazole-2,5(1H,3H)-dione
Smiles: CCN1C(=O)N(C2C1N(CN1CCOCC1)C(=O)N2CC)CN1CCOCC1
STK528036
Synonyms: methyl3-({[4-(2-methoxyphenyl)piperazin-1-yl]acetyl}amino)-5-methyl-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccccc1OC)cc(cc2)C
STK528037
Synonyms: 8-bromo-3-(4-methoxybenzyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc(cc1)Cn1cnc2c(c1=O)[nH]c1c2cc(cc1)Br
STK528038
Synonyms: 1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1H-tetrazole-5-thiol
Smiles: Sc1nnnn1C12CC3CC(C2)CC(C1)C3
STK528039
Synonyms: (2E)-2-[4-(heptyloxy)benzylidene]-N-[4-(2-methylpropoxy)benzyl]hydrazinecarbothioamide
Smiles: CCCCCCCOc1ccc(cc1)/C=N/NC(=S)NCc1ccc(cc1)OCC(C)C
STK528040
Synonyms: 3-{[(E)-(2,4-dihydroxyphenyl)methylidene]amino}-8-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: COc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1ccc(cc1O)O
STK528041
Synonyms: 3,3'-({3-[(2,4-dichlorophenoxy)methyl]-4-methoxyphenyl}methanediyl)bis(4-hydroxy-2H-chromen-2-one)
Smiles: COc1ccc(cc1COc1ccc(cc1Cl)Cl)C(c1c(=O)oc2c(c1O)cccc2)c1c(=O)oc2c(c1O)cccc2
STK528042
Synonyms: 8-{[(2Z)-3-chlorobut-2-en-1-yl]sulfanyl}-3-methyl-7-nonyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCn1c(SC/C=C(\Cl)/C)nc2c1c(=O)[nH]c(=O)n2C
STK528043
Synonyms: (2E)-2-(4-ethoxybenzylidene)-6,7-dimethyl[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Smiles: CCOc1ccc(cc1)/C=c\1/sc2n(c1=O)c1c(n2)cc(c(c1)C)C
STK528046
Synonyms: 4-[2-amino-3-cyano-4,4-bis(trifluoromethyl)-5,6,7,8-tetrahydroquinolin-1(4H)-yl]-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide
Smiles: N#CC1=C(N)N(c2ccc(cc2)S(=O)(=O)Nc2nc(C)cc(n2)C)C2=C(C1(C(F)(F)F)C(F)(F)F)CCCC2
STK528047
Synonyms: 3-{[(E)-quinolin-2-ylmethylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: O=c1n(/N=C/c2ccc3c(n2)cccc3)cnc2c1[nH]c1c2cccc1
STK528050
Synonyms: 2-(4-chlorophenyl)-4-[(2E)-2-(2-methoxybenzylidene)hydrazinyl]quinazoline
Smiles: COc1ccccc1/C=N/Nc1nc(nc2c1cccc2)c1ccc(cc1)Cl
STK528051
Synonyms: methyl3-({[(3R)-4-(3-methoxyphenyl)-3-methylpiperazin-1-yl]acetyl}amino)-5-methyl-1H-indole-2-carboxylate
Smiles: COc1cccc(c1)N1CCN(CC1C)CC(=O)Nc1c([nH]c2c1cc(C)cc2)C(=O)OC
STK528052
Synonyms: diethyl1-(3,5-dimethoxybenzyl)-2,5-dimethyl-1H-pyrrole-3,4-dicarboxylate
Smiles: CCOC(=O)c1c(C)n(c(c1C(=O)OCC)C)Cc1cc(OC)cc(c1)OC
STK528053
Synonyms: 8-methoxy-3-{[(E)-(4-nitrophenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc(cc1)[N+](=O)[O-]
STK528055
Synonyms: ethyl2-[4-({[(2,4-dichlorophenyl)carbonyl]carbamothioyl}amino)-3-methylphenyl]-3,3,3-trifluoro-2-hydroxypropanoate
Smiles: CCOC(=O)C(C(F)(F)F)(c1ccc(c(c1)C)NC(=S)NC(=O)c1ccc(cc1Cl)Cl)O
STK528056
Synonyms: 7-[(furan-2-ylmethyl)amino]-1-methyl-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione
Smiles: O=c1c2c3[nH]c4c(C)cccc4oc3cc(c2c(=O)c2c1cccc2)NCc1ccco1
STK528057
Synonyms: (2,2,2',2',4,4'-hexamethyl-1,2,3,4-tetrahydro-4,6'-biquinolin-1'(2'H)-yl)(4-iodophenyl)methanone
Smiles: Ic1ccc(cc1)C(=O)N1c2ccc(cc2C(=CC1(C)C)C)C1(C)CC(C)(C)Nc2c1cccc2
STK528058
Synonyms: (2Z)-1-(3-methoxyphenyl)-3-[(2-nitrophenyl)amino]prop-2-en-1-one
Smiles: COc1cccc(c1)C(=O)/C=C\Nc1ccccc1[N+](=O)[O-]
STK528059
Synonyms: 2-(4-ethoxyphenyl)-1-ethyl-5,6-dihydrodipyrrolo[1,2-a:2',1'-c]pyrazine
Smiles: CCOc1ccc(cc1)c1cn2c(c1CC)c1cccn1CC2
STK528061
Synonyms: 4-{(2E)-2-[1-(4-bromophenyl)ethylidene]hydrazinyl}-2-(2-chlorophenyl)quinazoline
Smiles: Brc1ccc(cc1)/C(=N/Nc1nc(nc2c1cccc2)c1ccccc1Cl)/C
STK528063
Synonyms: 7-[(2Z)-3-chlorobut-2-en-1-yl]-8-{(2E)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: C/C(=C/Cn1c(N/N=C(/c2ccc(cc2)Cl)\C)nc2c1c(=O)[nH]c(=O)n2C)/Cl
STK528064
Synonyms: 4-bromo-N-[(1Z)-7-ethoxy-4,4-dimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-ylidene]aniline
Smiles: CCOc1ccc2c(c1)NC(c1c2/c(=N/c2ccc(cc2)Br)/ss1)(C)C
STK528065
Synonyms: ethyl3-[(E)-pyrrolidin-1-yldiazenyl]-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1/N=N/N1CCCC1)cccc2
STK528069
Synonyms: 5-bromo-2-iodo-N-[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]benzamide
Smiles: Brc1ccc(c(c1)C(=O)Nc1cc(ccc1C)c1nc2c(o1)cccn2)I
STK528070
Synonyms: 3-[2-(cyclohex-1-en-1-yl)ethyl]-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Cc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)CCC1=CCCCC1
STK528072
Synonyms: ethylN-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-3,3,3-trifluoro-2-[(phenylcarbonyl)amino]alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(Nc1sc2c(c1C#N)CCCCC2)NC(=O)c1ccccc1
STK528073
Synonyms: 8-(dodecylsulfanyl)-3-methyl-7-(3-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCSc1nc2c(n1Cc1cccc(c1)C)c(=O)[nH]c(=O)n2C
STK528074
Synonyms: 2-chloro-N-(2,3-dimethylphenyl)-N-(2-ethoxyethyl)benzamide
Smiles: CCOCCN(c1cccc(c1C)C)C(=O)c1ccccc1Cl
STK528075
Synonyms: 4-{(2Z)-5,7-dibromo-2-[2-(4-nitrophenoxy)ethylidene]-2,3-dihydro-1-benzofuran-3-yl}morpholine
Smiles: Brc1cc2C(N3CCOCC3)/C(=C/COc3ccc(cc3)[N+](=O)[O-])/Oc2c(c1)Br
STK528076
Synonyms: methyl2-(2,2'-bithiophen-5-yl)quinoline-4-carboxylate
Smiles: COC(=O)c1cc(nc2c1cccc2)c1ccc(s1)c1cccs1
STK528077
Synonyms: 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-4-(4-methoxyphenyl)-6-phenylpyridine-3-carbonitrile
Smiles: COc1ccc(cc1)c1cc(nc(c1C#N)SCC(=O)c1ccc(cc1)Br)c1ccccc1
STK528079
Synonyms: N-(4-chlorobenzyl)-N'-[4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,3-thiazol-2-yl]ethanediamide
Smiles: Clc1ccc(cc1)CNC(=O)C(=O)Nc1scc(n1)C12CC3CC(C2)CC(C1)C3
STK528081
Synonyms: 4-(4-fluorophenoxy)-N-(furan-2-ylmethyl)butan-1-amine
Smiles: Fc1ccc(cc1)OCCCCNCc1ccco1
STK528082
Synonyms: 3-({7-[(2E)-3-chlorobut-2-en-1-yl]-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}sulfanyl)propanoicacid
Smiles: OC(=O)CCSc1nc2c(n1C/C=C(/Cl)\C)c(=O)[nH]c(=O)n2C
STK528083
Synonyms: 8-chloro-3-[2-(piperazin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Clc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)CCN1CCNCC1
STK528085
Synonyms: 2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-1-(5-methoxy-1H-indol-3-yl)ethanone
Smiles: COc1ccc2c(c1)c(c[nH]2)C(=O)CN1CCN(CC1)c1cccc(c1C)C
STK528087
Synonyms: methyl3-({[4-(phenylcarbonyl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C(=O)c1ccccc1)cccc2
STK528088
Synonyms: 2-(4-methoxyphenyl)-1-[2-(4-methylpiperazin-1-yl)ethyl]-1H-imidazo[1,2-a]benzimidazole
Smiles: COc1ccc(cc1)c1cn2c(n1CCN1CCN(CC1)C)nc1c2cccc1
STK528091
Synonyms: 4-(3-methylpyridinium-1-yl)-2-oxo-5-{(E)-[2-(phenylcarbonyl)hydrazinylidene]methyl}-1,3-thiazol-3-ide
Smiles: O=c1[n-]c(c(s1)/C=N/NC(=O)c1ccccc1)[n+]1cccc(c1)C
STK528092
Synonyms: 4-[(2E)-2-(4-bromobenzylidene)hydrazinyl]-2-(4-chlorophenyl)quinazoline
Smiles: Clc1ccc(cc1)c1nc(N/N=C/c2ccc(cc2)Br)c2c(n1)cccc2
STK528093
Synonyms: 1-[6-(2,6-dimethoxyphenoxy)hexyl]-4-methylpiperazine
Smiles: COc1cccc(c1OCCCCCCN1CCN(CC1)C)OC
STK528095
Synonyms: 7-[2-hydroxy-3-(2-methylphenoxy)propyl]-3-methyl-8-[(2Z)-2-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(Cn1c(N/N=C/2\C(=O)Nc3c2cccc3)nc2c1c(=O)[nH]c(=O)n2C)COc1ccccc1C
STK528096
Synonyms: N-[2-(diethylamino)ethyl]-N'-(1,3-thiazol-2-yl)ethanediamide
Smiles: CCN(CCNC(=O)C(=O)Nc1nccs1)CC
STK528097
Synonyms: 2-(3,4-dichlorophenyl)-N-(2,5-dimethoxyphenyl)quinazolin-4-amine
Smiles: COc1ccc(c(c1)Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl)OC
STK528101
Synonyms: 1-(pentabromobenzyl)piperidine
Smiles: Brc1c(CN2CCCCC2)c(Br)c(c(c1Br)Br)Br
STK528104
Synonyms: ethyl5-methoxy-3-[(E)-pyrrolidin-1-yldiazenyl]-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1/N=N/N1CCCC1)cc(cc2)OC
STK528105
Synonyms: diethyl{(4-methoxyphenyl)[(3-nitrophenyl)amino]methyl}phosphonate
Smiles: CCOP(=O)(C(c1ccc(cc1)OC)Nc1cccc(c1)[N+](=O)[O-])OCC
STK528109
Synonyms: 2-[(2,2-dimethoxyethyl)(methyl)amino]-1-(1H-indol-3-yl)ethanone
Smiles: COC(CN(CC(=O)c1c[nH]c2c1cccc2)C)OC
STK528111
Synonyms: 3-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-5-[(4-methoxyphenyl)amino]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Smiles: COc1ccc(cc1)Nc1cc(NCCC2=CCCCC2)c2c3c1C(=O)c1ccccc1c3on2
STK528114
Synonyms: (5Z)-1-(2-fluorophenyl)-5-({[2-(pyridin-3-yl)piperidin-1-yl]amino}methylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1NC(=O)N(C(=O)/C/1=C\NN1CCCCC1c1cccnc1)c1ccccc1F
STK528115
Synonyms: {1-[(1Z)-3-(4-bromophenyl)-3-oxo-1-phenylprop-1-en-2-yl]pyridin-2(1H)-ylidene}propanedinitrile
Smiles: N#CC(=c1ccccn1/C(=C\c1ccccc1)/C(=O)c1ccc(cc1)Br)C#N
STK528117
Synonyms: 2-(2-chlorophenyl)-4-[(2E)-2-(2-methoxybenzylidene)hydrazinyl]quinazoline
Smiles: COc1ccccc1/C=N/Nc1nc(nc2c1cccc2)c1ccccc1Cl
STK528120
Synonyms: ethyl(2-{[(4-hydroxy-2-oxo-1-propyl-1,2-dihydroquinolin-3-yl)carbonyl]amino}-1,3-thiazol-4-yl)acetate
Smiles: CCOC(=O)Cc1csc(n1)NC(=O)c1c(O)c2ccccc2n(c1=O)CCC
STK528121
Synonyms: 2-(4-chlorophenyl)-N-(2,4-dichlorophenyl)quinazolin-4-amine
Smiles: Clc1ccc(cc1)c1nc(Nc2ccc(cc2Cl)Cl)c2c(n1)cccc2
STK528123
Synonyms: 3-{[(1E)-3-(4-tert-butylphenyl)-2-methylpropylidene]amino}-8-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: COc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/C(Cc1ccc(cc1)C(C)(C)C)C
STK528124
Synonyms: N-{2-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}pyridine-3-carboxamide
Smiles: N#Cc1c(sc2c1CCCCC2)NC(C(F)(F)F)(C(F)(F)F)NC(=O)c1cccnc1
STK528125
Synonyms: 4-[(E)-(4-hydroxy-3-{[(triethylstannanyl)oxy]carbonyl}phenyl)diazenyl]-N-(pyridin-2-yl)benzenesulfonamide
Smiles: CC[Sn](OC(=O)c1cc(/N=N/c2ccc(cc2)S(=O)(=O)Nc2ccccn2)ccc1O)(CC)CC
STK528127
Synonyms: 1,5-bis(4-methoxyphenyl)-3-phenylpentane-1,5-dione
Smiles: COc1ccc(cc1)C(=O)CC(c1ccccc1)CC(=O)c1ccc(cc1)OC
STK528128
Synonyms: 3-methyl-8-(nonylsulfanyl)-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: C=CCn1c(SCCCCCCCCC)nc2c1c(=O)[nH]c(=O)n2C
STK528129
Synonyms: 3-methyl-8-[(2E)-2-(4-nitrobenzylidene)hydrazinyl]-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCn1c(N/N=C/c2ccc(cc2)[N+](=O)[O-])nc2c1c(=O)[nH]c(=O)n2C
STK528130
Synonyms: N-{2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}pyridine-4-carboxamide
Smiles: N#Cc1c(sc2c1CCCC2)NC(C(F)(F)F)(C(F)(F)F)NC(=O)c1ccncc1
STK528131
Synonyms: 2-(pentachlorophenyl)-4,5-diphenyl-1H-imidazole
Smiles: Clc1c(Cl)c(c2nc(c([nH]2)c2ccccc2)c2ccccc2)c(c(c1Cl)Cl)Cl
STK528132
Synonyms: 3,4-dimethyl-N-[(1Z)-4,4,6-trimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-ylidene]aniline
Smiles: Cc1cc(ccc1C)/N=c/1\ssc2c1c1cccc(c1NC2(C)C)C
STK528135
Synonyms: methyl3-{[3-(4-benzylpiperidin-1-yl)propanoyl]amino}-5-methyl-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CCN1CCC(CC1)Cc1ccccc1)cc(cc2)C
STK528136
Synonyms: 10-[2-hydroxy-3-(piperidin-1-yl)propyl]acridin-9(10H)-one
Smiles: OC(Cn1c2ccccc2c(=O)c2c1cccc2)CN1CCCCC1
STK528137
Synonyms: 4-(azepan-1-yl)-2-(2,4-dichlorophenyl)quinazoline
Smiles: Clc1ccc(c(c1)Cl)c1nc(N2CCCCCC2)c2c(n1)cccc2
STK528138
Synonyms: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(1,2-dimethyl-1H-indol-3-yl)ethanone
Smiles: O=C(c1c(C)n(c2c1cccc2)C)CN1CCN(CC1)Cc1ccc2c(c1)OCO2
STK528139
Synonyms: 2-{2-oxo-2-[(triethylstannanyl)oxy]ethyl}-1H-isoindole-1,3(2H)-dione
Smiles: CC[Sn](OC(=O)CN1C(=O)c2c(C1=O)cccc2)(CC)CC
STK528140
Synonyms: 1-(diphenylmethyl)-4-{2-[2-(4-fluorophenoxy)ethoxy]ethyl}piperazine
Smiles: Fc1ccc(cc1)OCCOCCN1CCN(CC1)C(c1ccccc1)c1ccccc1
STK528142
Synonyms: 7-[(furan-2-ylmethyl)amino]-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione
Smiles: O=c1c2c3[nH]c4ccccc4oc3cc(c2c(=O)c2c1cccc2)NCc1ccco1
STK528144
Synonyms: N-[(1E)-1-(3,4-dimethoxyphenyl)-3-{(2E)-2-[1-(4-fluorophenyl)ethylidene]hydrazinyl}-3-oxoprop-1-en-2-yl]benzamide
Smiles: COc1ccc(cc1OC)/C=C(\C(=O)N/N=C(/c1ccc(cc1)F)\C)/NC(=O)c1ccccc1
STK528146
Synonyms: 3-(4-chlorophenyl)-1-(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)-1-(2-phenylethyl)urea
Smiles: CC1CN=C(S1)N(C(=O)Nc1ccc(cc1)Cl)CCc1ccccc1
STK528152
Synonyms: 4,4'-{[4-(dimethylamino)phenyl](hydroxy)methanediyl}bis(1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one)
Smiles: CN(c1ccc(cc1)C(c1c(C)n(n(c1=O)c1ccccc1)C)(c1c(C)n(n(c1=O)c1ccccc1)C)O)C
STK528153
Synonyms: N-[(4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-3-yl)carbamothioyl]benzamide
Smiles: S=C(Nn1cnc2c(c1=O)C1(CCCCC1)Cc1c2cccc1)NC(=O)c1ccccc1
STK528154
Synonyms: 6-[(2-amino-2-oxo-1-phenylethyl)sulfanyl]-5-cyano-4-(3,4-dimethoxyphenyl)-N-(2-methoxyphenyl)-2-methylpyridine-3-carboxamide
Smiles: N#Cc1c(nc(c(c1c1ccc(c(c1)OC)OC)C(=O)Nc1ccccc1OC)C)SC(c1ccccc1)C(=O)N
STK528155
Synonyms: 7-heptyl-8-hydrazinyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCn1c(NN)nc2c1c(=O)[nH]c(=O)n2C
STK528156
Synonyms: biphenyl-2-yl(4,4,6-trimethyl-1-thioxo-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl)methanone
Smiles: O=C(N1c2c(C)cccc2c2c(C1(C)C)ssc2=S)c1ccccc1c1ccccc1
STK528157
Synonyms: 2-(2,4-dichlorophenyl)-N-(3-fluorophenyl)quinazolin-4-amine
Smiles: Clc1ccc(c(c1)Cl)c1nc(Nc2cccc(c2)F)c2c(n1)cccc2
STK528158
Synonyms: 1-methyl-7-[(4-methylphenyl)amino]-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione
Smiles: Cc1ccc(cc1)Nc1cc2oc3cccc(c3[nH]c2c2c1c(=O)c1ccccc1c2=O)C
STK528159
Synonyms: 6-hydroxy-3,4-dihydro-2H,8H-pyrimido[2,1-b][1,3]thiazin-8-one
Smiles: O=c1cc(O)n2c(n1)SCCC2
STK528160
Synonyms: 1,7-dibenzyl-3-methyl-8-(propan-2-ylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(Sc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)Cc1ccccc1)C
STK528164
Synonyms: N-(2-chloropyridin-3-yl)-4,6-dimethyl-2-oxo-2H-pyran-5-carboxamide
Smiles: O=c1cc(C)c(c(o1)C)C(=O)Nc1cccnc1Cl
STK528166
Synonyms: 2-{[(E)-(5-iodofuran-2-yl)methylidene]amino}-4,5-diphenylfuran-3-carbonitrile
Smiles: N#Cc1c(/N=C/c2ccc(o2)I)oc(c1c1ccccc1)c1ccccc1
STK528168
Synonyms: 3-methyl-8-[(2E)-2-(3-nitrobenzylidene)hydrazinyl]-7-octyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCn1c(N/N=C/c2cccc(c2)[N+](=O)[O-])nc2c1c(=O)[nH]c(=O)n2C
STK528170
Synonyms: methyl5-bromo-3-[({4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}acetyl)amino]-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1cccc(c1)C(F)(F)F)cc(cc2)Br
STK528172
Synonyms: 4-hydroxy-N-(2-hydroxyethyl)-2-oxo-1,2-dihydroquinoline-3-carboxamide
Smiles: OCCNC(=O)c1c(=O)[nH]c2c(c1O)cccc2
STK528173
Synonyms: ethyl3-[({1-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}acetyl)amino]-5-methoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCc3c(C1CN1C(=O)c4c(C1=O)cccc4)cccc3)cc(cc2)OC
STK528175
Synonyms: 3-{[(E)-(3-nitrophenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: [O-][N+](=O)c1cccc(c1)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1
STK528176
Synonyms: 1,1'-(3,9-dimethyldipyrrolo[1,2-a:2',1'-c]pyrazine-1,8-diyl)bis(trifluoroethanone)
Smiles: Cc1cc(c2n1ccn1c2cc(c1C(=O)C(F)(F)F)C)C(=O)C(F)(F)F
STK528177
Synonyms: 1-ethyl-6-fluoro-N-(3-methylbutyl)-7-(4-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CCn1cc(C(=O)NCCC(C)C)c(=O)c2c1cc(N1CCN(CC1)C)c(c2)F
STK528179
Synonyms: 2-(2,4-dichlorophenyl)-N-[3-(trifluoromethyl)phenyl]quinazolin-4-amine
Smiles: Clc1ccc(c(c1)Cl)c1nc(Nc2cccc(c2)C(F)(F)F)c2c(n1)cccc2
STK528181
Synonyms: (4-chlorophenyl)(2,2,2',2',4,4'-hexamethyl-1,2,3,4-tetrahydro-4,6'-biquinolin-1'(2'H)-yl)methanone
Smiles: Clc1ccc(cc1)C(=O)N1c2ccc(cc2C(=CC1(C)C)C)C1(C)CC(C)(C)Nc2c1cccc2
STK528182
Synonyms: N-(diphenylacetyl)-beta-alanine
Smiles: O=C(C(c1ccccc1)c1ccccc1)NCCC(=O)O
STK528183
Synonyms: 3-{[(triethylstannanyl)oxy]carbonyl}pyridine
Smiles: CC[Sn](OC(=O)c1cccnc1)(CC)CC
STK528184
Synonyms: 8-[(2E)-2-(4-chlorobenzylidene)hydrazinyl]-7-(2-methoxyethyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COCCn1c(N/N=C/c2ccc(cc2)Cl)nc2c1c(=O)[nH]c(=O)n2C
STK528185
Synonyms: 8-methoxy-3-{[(E)-(4-methoxy-3-{[4-(2-methoxyphenyl)piperazin-1-yl]methyl}phenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc(c(c1)CN1CCN(CC1)c1ccccc1OC)OC
STK528186
Synonyms: 5,5'-sulfanediylbis(1-methyl-4-nitro-1H-imidazole)
Smiles: Cn1cnc(c1Sc1n(C)cnc1[N+](=O)[O-])[N+](=O)[O-]
STK528190
Synonyms: 3-[2-(diethylamino)ethyl]-8-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: CCN(CCn1cnc2c(c1=O)[nH]c1c2cc(cc1)OC)CC
STK528191
Synonyms: 4-[(2E)-2-(3-nitrobenzylidene)hydrazinyl][1,2,4]triazolo[4,3-a]quinoxaline
Smiles: [O-][N+](=O)c1cccc(c1)/C=N/Nc1nc2ccccc2n2c1nnc2
STK528193
Synonyms: N-(4-methoxybenzyl)-8-methyl-5H-pyrimido[5,4-b]indol-4-amine
Smiles: COc1ccc(cc1)CNc1ncnc2c1[nH]c1c2cc(cc1)C
STK528194
Synonyms: 3-{[(E)-(3-hydroxy-4-methoxyphenyl)methylidene]amino}-8-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: COc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1ccc(c(c1)O)OC
STK528197
Synonyms: (2E)-2-[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]-3-[(2-methyl-4-nitrophenyl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1C)[N+](=O)[O-])/c1scc(n1)c1ccc(cc1Cl)Cl
STK528200
Synonyms: 1,7-dibenzyl-8-[(2E)-2-(5-bromo-2-hydroxybenzylidene)hydrazinyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Brc1ccc(c(c1)/C=N/Nc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)Cc1ccccc1)O
STK528201
Synonyms: 8-bromo-3-{[(E)-(3-iodophenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Brc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cccc(c1)I
STK528202
Synonyms: (2E)-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-{[4-(propan-2-yl)phenyl]amino}prop-2-enenitrile
Smiles: COc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccc(cc1)C(C)C)/C#N
STK528203
Synonyms: 3-{[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1cc(ccc1O)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1
STK528207
Synonyms: 7-methyl-7-(morpholin-4-yl)-4,5,7,8-tetrahydro-8aH-[1,2,5]oxadiazolo[3,4-e]indol-8a-ol6-oxide
Smiles: [O-][N+]1=C2CCc3c(C2(CC1(C)N1CCOCC1)O)non3
STK528208
Synonyms: 2-[4-(2-hydroxyethyl)piperazin-1-yl]-1-(5-methoxy-1,2-dimethyl-1H-indol-3-yl)ethanone
Smiles: OCCN1CCN(CC1)CC(=O)c1c2cc(OC)ccc2n(c1C)C
STK528209
Synonyms: 3-{[(E)-(4-hydroxyphenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Oc1ccc(cc1)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1
STK528210
Synonyms: hexa-2,4-diyne-1,6-diylbis(4-nitrobenzoate)
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])OCC#CC#CCOC(=O)c1ccc(cc1)[N+](=O)[O-]
STK528211
Synonyms: [3-amino-4-(thiophen-2-yl)-5,6,7,8-tetrahydrothieno[2,3-b]quinolin-2-yl](3-methylphenyl)methanone
Smiles: Cc1cccc(c1)C(=O)c1sc2c(c1N)c(c1cccs1)c1c(n2)CCCC1
STK528212
Synonyms: 4-(4-ethylpyridinium-1-yl)-5-formyl-2-oxo-1,3-thiazol-3-ide
Smiles: CCc1cc[n+](cc1)c1[n-]c(=O)sc1C=O
STK528213
Synonyms: 2-[2-(3,4-dimethoxyphenyl)ethyl]-N,N-diethyl-1,3-dioxo-2,3-dihydro-1H-benzo[de]isoquinoline-6-carboxamide
Smiles: COc1cc(ccc1OC)CCn1c(=O)c2cccc3c2c(c1=O)ccc3C(=O)N(CC)CC
STK528215
Synonyms: 4-(4-fluorophenoxy)-N-(tetrahydrofuran-2-ylmethyl)butan-1-amine
Smiles: Fc1ccc(cc1)OCCCCNCC1CCCO1
STK528216
Synonyms: 3,7-dimethyl-8-(nonylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCSc1nc2c(n1C)c(=O)[nH]c(=O)n2C
STK528217
Synonyms: 2-[(1E)-1-{2-[2-(3,4-dichlorophenyl)quinazolin-4-yl]hydrazinylidene}ethyl]phenol
Smiles: Oc1ccccc1/C(=N/Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl)/C
STK528218
Synonyms: ethyl5'-{[(phenylsulfanyl)acetyl]amino}-2,3'-bithiophene-4'-carboxylate
Smiles: CCOC(=O)c1c(scc1c1cccs1)NC(=O)CSc1ccccc1
STK528219
Synonyms: 1-(3-chloro-9,10-dioxo-9,10-dihydroanthracen-2-yl)-3-naphthalen-1-ylurea
Smiles: O=C(Nc1cccc2c1cccc2)Nc1cc2c(cc1Cl)C(=O)c1c(C2=O)cccc1
STK528220
Synonyms: 3,4,5,6-tetrachloro-N-{2-[4-phenyl-2-(propan-2-yl)tetrahydro-2H-pyran-4-yl]ethyl}pyridine-2-carboxamide
Smiles: CC(C1OCCC(C1)(CCNC(=O)c1nc(Cl)c(c(c1Cl)Cl)Cl)c1ccccc1)C
STK528223
Synonyms: 2-(4-chlorophenyl)-4-[(2E)-2-(2-fluorobenzylidene)hydrazinyl]quinazoline
Smiles: Clc1ccc(cc1)c1nc(N/N=C/c2ccccc2F)c2c(n1)cccc2
STK528224
Synonyms: 4-(3,5-dimethylpyridinium-1-yl)-2-oxo-5-{(E)-[2-(phenylcarbonyl)hydrazinylidene]methyl}-1,3-thiazol-3-ide
Smiles: Cc1cc(C)c[n+](c1)c1[n-]c(=O)sc1/C=N/NC(=O)c1ccccc1
STK528225
Synonyms: butyl4-(1H-naphtho[1,2-e][1,3]oxazin-2(3H)-yl)benzoate
Smiles: CCCCOC(=O)c1ccc(cc1)N1COc2c(C1)c1ccccc1cc2
STK528226
Synonyms: methyl3-({3-[4-(4-fluorophenyl)piperazin-1-yl]propanoyl}amino)-5-methyl-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1ccc(cc1)F)cc(cc2)C
STK528228
Synonyms: methyl3-({[3-(ethoxycarbonyl)piperidin-1-yl]acetyl}amino)-5-methyl-1H-indole-2-carboxylate
Smiles: CCOC(=O)C1CCCN(C1)CC(=O)Nc1c([nH]c2c1cc(C)cc2)C(=O)OC
STK528229
Synonyms: 2-bromo-6-{(E)-[2-(4-methoxyphenyl)hydrazinylidene]methyl}phenol
Smiles: COc1ccc(cc1)N/N=C/c1cccc(c1O)Br
STK528230
Synonyms: methyl5-chloro-3-{[(4-methylpiperidin-1-yl)acetyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCC(CC1)C)cc(cc2)Cl
STK528231
Synonyms: 7,7'-piperazine-1,4-diylbis(N,N-diethyl-4-nitro-2,1,3-benzoxadiazol-5-amine)
Smiles: CCN(c1cc(N2CCN(CC2)c2cc(N(CC)CC)c(c3c2non3)[N+](=O)[O-])c2c(c1[N+](=O)[O-])non2)CC
STK528232
Synonyms: 2-methoxy-4-[(E)-{2-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)carbonyl]hydrazinylidene}methyl]phenylnaphthalene-1-carboxylate
Smiles: COc1cc(/C=N/NC(=O)c2c(C)onc2c2ccccc2)ccc1OC(=O)c1cccc2c1cccc2
STK528233
Synonyms: 1-{1-[1-(2,6-dimethylphenyl)-1H-tetrazol-5-yl]cyclopentyl}-4-nitrosopiperazine
Smiles: O=NN1CCN(CC1)C1(CCCC1)c1nnnn1c1c(C)cccc1C
STK528235
Synonyms: 1-[4-(naphthalen-1-yloxy)butyl]-4-[3-(trifluoromethyl)phenyl]piperazine
Smiles: FC(c1cccc(c1)N1CCN(CC1)CCCCOc1cccc2c1cccc2)(F)F
STK528236
Synonyms: 8-chloro-1-(2-chloroethyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: ClCCn1c(=O)n(C)c2c(c1=O)n(C)c(n2)Cl
STK528238
Synonyms: 6-{(E)-[2-(4-hydroxyphenyl)hydrazinylidene]methyl}-2,3-dimethoxybenzoicacid
Smiles: COc1c(OC)ccc(c1C(=O)O)/C=N/Nc1ccc(cc1)O
STK528239
Synonyms: 6-bromo-1-{(E)-[(5-chloropyridin-2-yl)imino]methyl}naphthalen-2-ol
Smiles: Clc1ccc(nc1)/N=C/c1c(O)ccc2c1ccc(c2)Br
STK528240
Synonyms: 8-(benzylsulfanyl)-7-hexadecyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCCCCCn1c(SCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C
STK528242
Synonyms: 6-{[2-(3-bromophenyl)-2-oxoethyl]sulfanyl}-5-cyano-4-(furan-2-yl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCC(=O)c2cccc(c2)Br)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1)C
STK528243
Synonyms: 1-(4-methoxybenzyl)-3,7-dimethyl-8-(4-methylpiperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1ccc(cc1)Cn1c(=O)n(C)c2c(c1=O)n(C)c(n2)N1CCC(CC1)C
STK528245
Synonyms: ethyl2-[(3-chloro-2-methylphenyl)amino]-N-[(2-chlorophenyl)carbonyl]-3,3,3-trifluoroalaninate
Smiles: CCOC(=O)C(C(F)(F)F)(Nc1cccc(c1C)Cl)NC(=O)c1ccccc1Cl
STK528247
Synonyms: 7-hexadecyl-3-methyl-8-[(3-phenylpropyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCCCCCn1c(SCCCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C
STK528248
Synonyms: 6,7,8,9,9a,10,11,12,13,14-decahydro-2H-benzimidazo[2,1-e]acridin-2-ylidenepropanedinitrile
Smiles: N#CC(=c1ccc2=NC34N(c2c1)C1=C(CCCC1)CC4CCCC3)C#N
STK528255
Synonyms: 8-methyl-4-(thiomorpholin-4-yl)-5H-pyrimido[5,4-b]indole
Smiles: Cc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCSCC1
STK528256
Synonyms: 2-(3,4-dichlorophenyl)-N-[3-(trifluoromethyl)phenyl]quinazolin-4-amine
Smiles: Clc1ccc(cc1Cl)c1nc(Nc2cccc(c2)C(F)(F)F)c2c(n1)cccc2
STK528257
Synonyms: N-benzyl-4,6-dimethyl-2-oxo-2H-pyran-5-carboxamide
Smiles: O=c1cc(C)c(c(o1)C)C(=O)NCc1ccccc1
STK528258
Synonyms: 4-[(E)-{2-[2-(2,4-dichlorophenyl)quinazolin-4-yl]hydrazinylidene}methyl]-2-methoxyphenol
Smiles: COc1cc(/C=N/Nc2nc(nc3c2cccc3)c2ccc(cc2Cl)Cl)ccc1O
STK528259
Synonyms: 4-(azepan-1-yl)-8-methyl-5H-pyrimido[5,4-b]indole
Smiles: Cc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCCCCC1
STK528261
Synonyms: {4-[2-(4-fluorophenoxy)ethyl]piperazin-1-yl}(furan-2-yl)methanone
Smiles: Fc1ccc(cc1)OCCN1CCN(CC1)C(=O)c1ccco1
STK528262
Synonyms: N-(4-bromophenyl)-2-(2-chlorophenyl)quinazolin-4-amine
Smiles: Brc1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccccc1Cl
STK528264
Synonyms: 3-[4-(dimethylamino)benzyl]-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Cc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)Cc1ccc(cc1)N(C)C
STK528265
Synonyms: N-[4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,3-thiazol-2-yl]-N'-undecylethanediamide
Smiles: CCCCCCCCCCCNC(=O)C(=O)Nc1scc(n1)C12CC3CC(C2)CC(C1)C3
STK528266
Synonyms: 4-(4-methoxyphenyl)-2-[2-(propan-2-yl)tetrahydro-2H-pyran-4-yl]-1,3-thiazole
Smiles: COc1ccc(cc1)c1csc(n1)C1CCOC(C1)C(C)C
STK528267
Synonyms: 4-ethyl-2-(4-methoxyphenyl)-5,5-dimethyl-2,5-dihydro-1H-imidazol-1-ol
Smiles: CCC1=NC(N(C1(C)C)O)c1ccc(cc1)OC
STK528269
Synonyms: 2-phenyl-4-{[(tricyclohexylstannanyl)oxy]carbonyl}quinoline
Smiles: O=C(c1cc(nc2c1cccc2)c1ccccc1)O[Sn](C1CCCCC1)(C1CCCCC1)C1CCCCC1
STK528270
Synonyms: 2-(2,4-dichlorophenyl)-4-[(2E)-2-(4-fluorobenzylidene)hydrazinyl]quinazoline
Smiles: Fc1ccc(cc1)/C=N/Nc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl
STK528271
Synonyms: (7Z)-N-(4-methylphenyl)-7-[(4-methylphenyl)imino]cyclohepta-1,3,5-trien-1-amine
Smiles: Cc1ccc(cc1)Nc1ccccc/c/1=N/c1ccc(cc1)C
STK528273
Synonyms: 3-{[(E)-(5-bromo-2-hydroxyphenyl)methylidene]amino}-8-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cc(Br)ccc1O
STK528274
Synonyms: 2,2-dimethyl-3-phenyl-7-(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)hept-5-yn-3-ol
Smiles: CC12CC(N(C1)CC#CCC(C(C)(C)C)(c1ccccc1)O)CC(C2)(C)C
STK528275
Synonyms: 5-cyano-4-(furan-2-yl)-2-methyl-6-[(2-methylbenzyl)sulfanyl]-N-phenyl-1,4-dihydropyridine-3-carboxamide
Smiles: N#CC1=C(SCc2ccccc2C)NC(=C(C1c1ccco1)C(=O)Nc1ccccc1)C
STK528276
Synonyms: ethyl3-[(E)-(4-benzylpiperidin-1-yl)diazenyl]-5-methoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1/N=N/N1CCC(CC1)Cc1ccccc1)cc(cc2)OC
STK528277
Synonyms: 8-(dodecylsulfanyl)-3-methyl-7-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCSc1nc2c(n1CCC(C)C)c(=O)[nH]c(=O)n2C
STK528279
Synonyms: ethyl3,3-dicyano-2-oxo-4-phenyl-2,3,4,4a,5,6,7,8-octahydronaphthalene-1-carboxylate
Smiles: CCOC(=O)C1=C2CCCCC2C(C(C1=O)(C#N)C#N)c1ccccc1
STK528280
Synonyms: 2-(4-ethylpiperazin-1-yl)-1-(1H-indol-3-yl)ethanone
Smiles: CCN1CCN(CC1)CC(=O)c1c[nH]c2c1cccc2
STK528282
Synonyms: 3-{[(E)-(2-hydroxyphenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Oc1ccccc1/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1
STK528283
Synonyms: 8,8'-(ethane-1,2-diyldisulfanediyl)bis(3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione)
Smiles: Cn1c(SCCSc2nc3c(n2C)c(=O)[nH]c(=O)n3C)nc2c1c(=O)[nH]c(=O)n2C
STK528285
Synonyms: 8-(diphenylmethoxy)-7-(3-methoxybenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1cccc(c1)Cn1c(OC(c2ccccc2)c2ccccc2)nc2c1c(=O)n(c(=O)n2C)C
STK528286
Synonyms: 2-chloro-3-{[3-(1H-imidazol-1-yl)propyl]amino}naphthalene-1,4-dione
Smiles: ClC1=C(NCCCn2cncc2)C(=O)c2c(C1=O)cccc2
STK528287
Synonyms: 3,4-dichloro-N-[(1Z)-8-methoxy-4,4-dimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-ylidene]aniline
Smiles: COc1ccc2c(c1)c1/c(=N/c3ccc(c(c3)Cl)Cl)/ssc1C(N2)(C)C
STK528289
Synonyms: 1-(9H-carbazol-9-yl)-3-[2-(pyridin-3-yl)-1H-benzimidazol-1-yl]propan-2-ol
Smiles: OC(Cn1c2ccccc2c2c1cccc2)Cn1c(nc2c1cccc2)c1cccnc1
STK528292
Synonyms: 7-decyl-8-[(2-hydroxyethyl)sulfanyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCn1c(SCCO)nc2c1c(=O)[nH]c(=O)n2C
STK528293
Synonyms: 8-methoxy-3-{[(E)-(3,4,5-trimethoxyphenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cc(OC)c(c(c1)OC)OC
STK528294
Synonyms: N-[(3Z)-5-(methylsulfanyl)-3H-1,2,4-dithiazol-3-ylidene]acetamide
Smiles: CSc1ss/c(=N\C(=O)C)/n1
STK528295
Synonyms: 1-[(3,5-di-tert-butyl-4-hydroxyphenyl)(morpholin-4-yl)methyl]naphthalen-2-ol
Smiles: Oc1ccc2c(c1C(c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)N1CCOCC1)cccc2
STK528296
Synonyms: 3-{[(E)-(4-nitrophenyl)methylidene]amino}-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: [O-][N+](=O)c1ccc(cc1)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cccc1
STK528298
Synonyms: 2,3-dimethoxy-6-{(E)-[2-({[(3,4,5-trimethoxyphenyl)carbonyl]amino}acetyl)hydrazinylidene]methyl}benzoicacid(non-preferredname)
Smiles: COc1c(OC)ccc(c1C(=O)O)/C=N/NC(=O)CNC(=O)c1cc(OC)c(c(c1)OC)OC
STK528299
Synonyms: 4-[(8-methoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)methyl]benzonitrile
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)Cc1ccc(cc1)C#N
STK528301
Synonyms: methyl3-{[(4-benzylpiperazin-1-yl)acetyl]amino}-5-bromo-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)Cc1ccccc1)cc(cc2)Br
STK528302
Synonyms: methyl3-({[4-(ethoxycarbonyl)piperidin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: CCOC(=O)C1CCN(CC1)CC(=O)Nc1c([nH]c2c1cccc2)C(=O)OC
STK528303
Synonyms: 2-[4-(2-fluorophenyl)piperazin-1-yl]-1-(5-methoxy-1H-indol-3-yl)ethanone
Smiles: COc1ccc2c(c1)c(c[nH]2)C(=O)CN1CCN(CC1)c1ccccc1F
STK528304
Synonyms: 2-(2-chlorophenyl)-N-(2-fluorophenyl)quinazolin-4-amine
Smiles: Fc1ccccc1Nc1nc(nc2c1cccc2)c1ccccc1Cl
STK528306
Synonyms: 7-[(2E)-but-2-en-1-yl]-3-methyl-8-[(2E)-2-(1-phenylethylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: C/C=C/Cn1c(N/N=C(/c2ccccc2)\C)nc2c1c(=O)[nH]c(=O)n2C
STK528309
Synonyms: 2-(4-chlorophenyl)-2-oxoethyl2,6-dimethylmorpholine-4-carbodithioate
Smiles: CC1OC(C)CN(C1)C(=S)SCC(=O)c1ccc(cc1)Cl
STK528310
Synonyms: 2-{[2-oxo-2-(thiophen-2-yl)ethyl]sulfanyl}-4-(pyridin-4-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Smiles: N#Cc1c(SCC(=O)c2cccs2)nc2c(c1c1ccncc1)CCCC2
STK528312
Synonyms: methyl3-{[(4-carbamoylpiperidin-1-yl)acetyl]amino}-5-chloro-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CC[C@H](CC1)C(=O)N)cc(cc2)Cl
STK528313
Synonyms: 1-ethyl-6-fluoro-7-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-4-oxo-N-(1,3,4-thiadiazol-2-yl)-1,4-dihydroquinoline-3-carboxamide
Smiles: CCn1cc(C(=O)Nc2nncs2)c(=O)c2c1cc(N1CCN(CC1)C(=O)c1ccco1)c(c2)F
STK528315
Synonyms: 3-[2-(4-chlorophenyl)-1H-imidazo[1,2-a]benzimidazol-1-yl]-N,N-diethylpropan-1-amine
Smiles: CCN(CCCn1c(cn2c1nc1c2cccc1)c1ccc(cc1)Cl)CC
STK528316
Synonyms: 2-(2,4-dichlorophenyl)-N-(3,4-dimethylphenyl)quinazolin-4-amine
Smiles: Clc1ccc(c(c1)Cl)c1nc(Nc2ccc(c(c2)C)C)c2c(n1)cccc2
STK528317
Synonyms: 2-(4-methoxyphenyl)-1-[3-(pyrrolidin-1-yl)propyl]-1H-imidazo[1,2-a]benzimidazole
Smiles: COc1ccc(cc1)c1cn2c(n1CCCN1CCCC1)nc1c2cccc1
STK528319
Synonyms: 3-{[(E)-(2-hydroxy-3-methoxyphenyl)methylidene]amino}-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: COc1cccc(c1O)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cccc1
STK528320
Synonyms: 3-[4-(dimethylamino)phenyl]-1,5-di(naphthalen-2-yl)pentane-1,5-dione
Smiles: O=C(c1ccc2c(c1)cccc2)CC(c1ccc(cc1)N(C)C)CC(=O)c1ccc2c(c1)cccc2
STK528321
Synonyms: 7-heptyl-3-methyl-8-sulfanyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCn1c(S)nc2c1c(=O)[nH]c(=O)n2C
STK528323
Synonyms: 3,3,3-trifluoro-N-{1,1,1,3,3,3-hexafluoro-2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]propan-2-yl}-2-(trifluoromethyl)propanamide
Smiles: O=C(C(C(F)(F)F)C(F)(F)F)NC(C(F)(F)F)(C(F)(F)F)Nc1nnc(s1)C
STK528325
Synonyms: 3-({7-[2-hydroxy-3-(2-methylphenoxy)propyl]-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}sulfanyl)propanoicacid
Smiles: OC(Cn1c(SCCC(=O)O)nc2c1c(=O)[nH]c(=O)n2C)COc1ccccc1C
STK528327
Synonyms: ethyl4-(heptylamino)-2-oxo-1,2-dihydroquinoline-3-carboxylate
Smiles: CCCCCCCNc1c2ccccc2[nH]c(=O)c1C(=O)OCC
STK528329
Synonyms: 6-bromo-3-[4-(9H-fluoren-2-yl)-1,3-thiazol-2-yl]-2H-chromen-2-one
Smiles: Brc1ccc2c(c1)cc(c(=O)o2)c1scc(n1)c1ccc2c(c1)Cc1c2cccc1
STK528331
Synonyms: 3-(1,1-dioxido-2H-1,2,4-benzothiadiazin-3-yl)-1-heptyl-4-hydroxyquinolin-2(1H)-one
Smiles: CCCCCCCn1c(=O)c(C2=Nc3ccccc3S(=O)(=O)N2)c(c2c1cccc2)O
STK528332
Synonyms: 3-heptyl-1-methyl-6,7-dihydro[1,3]thiazolo[2,3-f]purine-2,4(1H,3H)-dione
Smiles: CCCCCCCn1c(=O)c2n3CCSc3nc2n(c1=O)C
STK528333
Synonyms: 5-(dimethylsulfonio)-1-(4-ethoxyphenyl)-2,4,6-trioxohexahydropyrimidin-5-ide
Smiles: CCOc1ccc(cc1)N1C(=O)NC(=O)[C-](C1=O)[S+](C)C
STK528334
Synonyms: 2-ethyl-N-[(1Z)-4,4,8-trimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-ylidene]aniline
Smiles: CCc1ccccc1/N=c/1\ssc2c1c1cc(C)ccc1NC2(C)C
STK528335
Synonyms: 1-[4-(4-fluorophenoxy)butyl]-4-(2-methoxyphenyl)piperazine
Smiles: COc1ccccc1N1CCN(CC1)CCCCOc1ccc(cc1)F
STK528337
Synonyms: 2-(3,4-dichlorophenyl)-4-methoxyquinazoline
Smiles: COc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl
STK528338
Synonyms: N-[(4Z)-7,7-dimethyl-2-(methylsulfanyl)-1-phenyl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-4-ylidene]-2,6-dimethylaniline
Smiles: CSC1=N/C(=N\c2c(C)cccc2C)/C2(N1c1ccccc1)CCOC(C2)(C)C
STK528341
Synonyms: 1,7-dibenzyl-8-{(2E)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccc(cc1)/C(=N/Nc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)Cc1ccccc1)/C
STK528342
Synonyms: decyl(2E)-3-[5-(4-bromophenyl)furan-2-yl]-2-cyanoprop-2-enoate
Smiles: CCCCCCCCCCOC(=O)/C(=C/c1ccc(o1)c1ccc(cc1)Br)/C#N
STK528344
Synonyms: 3-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-5-(phenylamino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Smiles: O=C1c2ccccc2c2c3c1c(Nc1ccccc1)cc(c3no2)NCCC1=CCCCC1
STK528346
Synonyms: methyl5-bromo-3-({[4-(2,3-dimethylphenyl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1cccc(c1C)C)cc(cc2)Br
STK528347
Synonyms: 3-{[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]amino}-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: COc1cc(ccc1O)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cccc1
STK528350
Synonyms: (2E)-2-[4-(6-bromo-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-3-{[3-(trifluoromethyl)phenyl]amino}prop-2-enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)C(F)(F)F)/c1scc(n1)c1cc2cc(Br)ccc2oc1=O
STK528352
Synonyms: propyl4-({[(1,3-benzodioxol-5-ylmethyl)amino](oxo)acetyl}amino)benzoate
Smiles: CCCOC(=O)c1ccc(cc1)NC(=O)C(=O)NCc1ccc2c(c1)OCO2
STK528353
Synonyms: methyl3-{[(4-benzylpiperidin-1-yl)acetyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCC(CC1)Cc1ccccc1)cccc2
STK528354
Synonyms: 3-methyl-7-(3-methylbutyl)-8-(nonylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCSc1nc2c(n1CCC(C)C)c(=O)[nH]c(=O)n2C
STK528355
Synonyms: 7-heptyl-3-methyl-8-(prop-2-en-1-ylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCn1c(SCC=C)nc2c1c(=O)[nH]c(=O)n2C
STK528358
Synonyms: N'-[(1E)-1-(6-bromo-2-oxo-2H-chromen-3-yl)ethylidene]benzohydrazide
Smiles: Brc1ccc2c(c1)cc(c(=O)o2)/C(=N/NC(=O)c1ccccc1)/C
STK528359
Synonyms: (2E)-4-({3-chloro-4-[(phenylcarbonyl)amino]phenyl}amino)-4-oxobut-2-enoicacid
Smiles: OC(=O)/C=C/C(=O)Nc1ccc(c(c1)Cl)NC(=O)c1ccccc1
STK528362
Synonyms: 2-(2,4-dichlorophenyl)-N-(2-fluorophenyl)quinazolin-4-amine
Smiles: Clc1ccc(c(c1)Cl)c1nc(Nc2ccccc2F)c2c(n1)cccc2
STK528363
Synonyms: 8-bromo-3-{[(E)-(2-hydroxy-5-methoxyphenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc(c(c1)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)Br)O
STK528364
Synonyms: 3-{[(E)-pyridin-4-ylmethylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: O=c1n(/N=C/c2ccncc2)cnc2c1[nH]c1c2cccc1
STK528365
Synonyms: 4,4'-{(2-hydroxy-5-methylbenzene-1,3-diyl)bis[(E)methylylidenenitrilo]}bis(2,5-dimethyl-1-phenyl-1,2-dihydro-3H-pyrazol-3-one)
Smiles: Cc1cc(/C=N/c2c(C)n(n(c2=O)C)c2ccccc2)c(c(c1)/C=N/c1c(C)n(n(c1=O)C)c1ccccc1)O
STK528366
Synonyms: 2-oxo-4-[4-(phenylcarbonyl)pyridinium-1-yl]-5-{(E)-[2-(pyridin-3-ylcarbonyl)hydrazinylidene]methyl}-1,3-thiazol-3-ide
Smiles: O=c1sc(c([n-]1)[n+]1ccc(cc1)C(=O)c1ccccc1)/C=N/NC(=O)c1cccnc1
STK528369
Synonyms: 8-(decylsulfanyl)-3-methyl-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCSc1nc2c(n1CCCc1ccccc1)c(=O)[nH]c(=O)n2C
STK528370
Synonyms: 8-(azepan-1-yl)-7-(3-bromobenzyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Brc1cccc(c1)Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCCCCC1
STK528371
Synonyms: 9H-benzo[5,6]chromeno[2,3-d][1,3]thiazole-9-thione
Smiles: S=c1nc2c(s1)cc1c(o2)ccc2c1cccc2
STK528372
Synonyms: 2-(2,4-dichlorophenyl)-4-[(2E)-2-(1-phenylethylidene)hydrazinyl]quinazoline
Smiles: Clc1ccc(c(c1)Cl)c1nc(N/N=C(/c2ccccc2)\C)c2c(n1)cccc2
STK528373
Synonyms: 6-hexyl-7-hydroxy-3-{4-[4-(phenylsulfanyl)phenyl]-1,3-thiazol-2-yl}-2H-chromen-2-one
Smiles: CCCCCCc1cc2cc(c3scc(n3)c3ccc(cc3)Sc3ccccc3)c(=O)oc2cc1O
STK528374
Synonyms: 8-bromo-3-{[(E)-(2-fluorophenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Brc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccccc1F
STK528375
Synonyms: 2-ethyl-N'-[(E)-quinolin-2-ylmethylidene]quinoline-4-carbohydrazide
Smiles: CCc1nc2ccccc2c(c1)C(=O)N/N=C/c1ccc2c(n1)cccc2
STK528378
Synonyms: 7-{4-methoxy-3-[(4-nitrophenoxy)methyl]phenyl}-6H,7H,8H-pyrano[3,2-c:5,6-c']dichromene-6,8-dione
Smiles: COc1ccc(cc1COc1ccc(cc1)[N+](=O)[O-])C1c2c(=O)oc3c(c2Oc2c1c(=O)oc1c2cccc1)cccc3
STK528379
Synonyms: (5E)-1-benzyl-5-(2,4-dimethoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1ccc(c(c1)OC)/C=C/1\C(=O)NC(=O)N(C1=O)Cc1ccccc1
STK528380
Synonyms: 7-(3-bromobenzyl)-8-[(2E)-2-(4-bromobenzylidene)hydrazinyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Brc1ccc(cc1)/C=N/Nc1nc2c(n1Cc1cccc(c1)Br)c(=O)[nH]c(=O)n2C
STK528381
Synonyms: methyl3-{[N-(2,2-dimethoxyethyl)-N-methylglycyl]amino}-5-methyl-1H-indole-2-carboxylate
Smiles: COC(CN(CC(=O)Nc1c([nH]c2c1cc(C)cc2)C(=O)OC)C)OC
STK528382
Synonyms: 2-chloro-1-(3-methyl-1H-indol-2-yl)ethanone
Smiles: ClCC(=O)c1[nH]c2c(c1C)cccc2
STK528383
Synonyms: dimethyl5,5'-{oxybis[benzene-4,1-diylnitrilo(E)methylylidene]}bis(2-methyl-4-phenyl-1H-pyrrole-3-carboxylate)
Smiles: COC(=O)c1c(C)[nH]c(c1c1ccccc1)/C=N/c1ccc(cc1)Oc1ccc(cc1)/N=C/c1[nH]c(c(c1c1ccccc1)C(=O)OC)C
STK528384
Synonyms: 4-[(E)-phenyldiazenyl]-N-[(E)-pyridin-4-ylmethylidene]aniline
Smiles: n1ccc(cc1)/C=N/c1ccc(cc1)/N=N/c1ccccc1
STK528385
Synonyms: 2-{[(1Z)-8-ethoxy-4,4-dimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-ylidene]amino}-4-methylphenol
Smiles: CCOc1ccc2c(c1)c1/c(=N/c3cc(C)ccc3O)/ssc1C(N2)(C)C
STK528386
Synonyms: butyl({7-[(2E)-3-chlorobut-2-en-1-yl]-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}sulfanyl)acetate
Smiles: CCCCOC(=O)CSc1nc2c(n1C/C=C(/Cl)\C)c(=O)[nH]c(=O)n2C
STK528388
Synonyms: 2-(biphenyl-4-yl)-4-(4-chlorophenyl)-5-phenyl-1H-imidazole
Smiles: Clc1ccc(cc1)c1nc([nH]c1c1ccccc1)c1ccc(cc1)c1ccccc1
STK528390
Synonyms: 6-{(E)-[2-({[(3,4-dimethoxyphenyl)carbonyl]amino}acetyl)hydrazinylidene]methyl}-2,3-dimethoxybenzoicacid(non-preferredname)
Smiles: COc1ccc(cc1OC)C(=O)NCC(=O)N/N=C/c1ccc(c(c1C(=O)O)OC)OC
STK528392
Synonyms: 8-[(2-hydroxyethyl)sulfanyl]-3-methyl-7-nonyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCn1c(SCCO)nc2c1c(=O)[nH]c(=O)n2C
STK528394
Synonyms: 3-decyl-1-methyl-6,7-dihydro[1,3]thiazolo[2,3-f]purine-2,4(1H,3H)-dione
Smiles: CCCCCCCCCCn1c(=O)c2n3CCSc3nc2n(c1=O)C
STK528395
Synonyms: 1-ethyl-6-fluoro-7-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-N-heptyl-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CCCCCCCNC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C(=O)c1ccco1)F
STK528396
Synonyms: 2-{6-oxo-6-[(tributylstannanyl)oxy]hexyl}-1H-isoindole-1,3(2H)-dione
Smiles: CCCC[Sn](OC(=O)CCCCCN1C(=O)c2c(C1=O)cccc2)(CCCC)CCCC
STK528397
Synonyms: [5,10,15,20-tetra(pyridin-3-yl)porphyrinato(2-)-kappa~2~N~21~,N~23~]copper
Smiles: c1ccc(cn1)C1=C2C=CC(=N2)C(=c2n3[Cu]n4c1ccc4C(=C1C=CC(=N1)C(=c3cc2)c1cccnc1)c1cccnc1)c1cccnc1
STK528398
Synonyms: 2-(dimethylamino)ethyltricyclo[3.3.1.1~3,7~]dec-1-ylcarbamate
Smiles: CN(CCOC(=O)NC12CC3CC(C2)CC(C1)C3)C
STK528401
Synonyms: 1-{(E)-[(5-bromopyridin-2-yl)imino]methyl}-6-nitronaphthalen-2-ol
Smiles: Brc1ccc(nc1)/N=C/c1c(O)ccc2c1ccc(c2)[N+](=O)[O-]
STK528402
Synonyms: N,N-dibutyl-1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CCCCN(C(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C)F)CCCC
STK528403
Synonyms: methyl5-[(E)-(2-carbamothioylhydrazinylidene)methyl]-2-methyl-4-phenyl-1H-pyrrole-3-carboxylate
Smiles: COC(=O)c1c(C)[nH]c(c1c1ccccc1)/C=N/NC(=S)N
STK528405
Synonyms: 3-(chloromethyl)-1,3-benzoxazol-2(3H)-one
Smiles: ClCn1c(=O)oc2c1cccc2
STK528407
Synonyms: 4-(biphenyl-4-yloxy)-2-(4-chlorophenyl)quinazoline
Smiles: Clc1ccc(cc1)c1nc(Oc2ccc(cc2)c2ccccc2)c2c(n1)cccc2
STK528408
Synonyms: 2-(2,4-dichlorophenyl)-4-[(2E)-2-(3,4-dimethoxybenzylidene)hydrazinyl]quinazoline
Smiles: COc1cc(/C=N/Nc2nc(nc3c2cccc3)c2ccc(cc2Cl)Cl)ccc1OC
STK528409
Synonyms: 3-{[(E)-1,3-benzodioxol-5-ylmethylidene]amino}-8-methyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: Cc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1ccc2c(c1)OCO2
STK528411
Synonyms: N'-(5-nitro-4,6-dioxotetrahydropyrimidin-2(1H)-ylidene)-2-(thiophen-2-yl)quinoline-4-carbohydrazide
Smiles: O=C1N/C(=N/NC(=O)c2cc(nc3c2cccc3)c2cccs2)/NC(=O)C1[N+](=O)[O-]
STK528412
Synonyms: (2Z)-2-[4-(6-bromo-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-3-[(4-ethoxyphenyl)amino]prop-2-enenitrile
Smiles: CCOc1ccc(cc1)N/C=C(\c1scc(n1)c1cc2cc(Br)ccc2oc1=O)/C#N
STK528413
Synonyms: 8-(hexylsulfanyl)-3-methyl-7-nonyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCn1c(SCCCCCC)nc2c1c(=O)[nH]c(=O)n2C
STK528415
Synonyms: 2-(4-chlorophenyl)-N-(4-methoxyphenyl)quinazolin-4-amine
Smiles: COc1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccc(cc1)Cl
STK528416
Synonyms: 6-methyl-1-nitroso-1,2,3,4-tetrahydroquinoline
Smiles: O=NN1CCCc2c1ccc(c2)C
STK528417
Synonyms: 3-{[(E)-(2,4-dichlorophenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Clc1ccc(c(c1)Cl)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1
STK528419
Synonyms: 3-[2-(dimethylamino)ethyl]-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: CN(CCn1cnc2c(c1=O)[nH]c1c2cc(cc1)C)C
STK528421
Synonyms: N'-(4-hydroxybutanoyl)tricyclo[3.3.1.1~3,7~]decane-1-carbohydrazide
Smiles: OCCCC(=O)NNC(=O)C12CC3CC(C2)CC(C1)C3
STK528422
Synonyms: 3-{[(E)-(3-chlorophenyl)methylidene]amino}-8-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cccc(c1)Cl
STK528423
Synonyms: 8-(azepan-1-yl)-3-methyl-7-nonyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCCCCC1
STK528424
Synonyms: 7-hexadecyl-3-methyl-8-(piperazin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCNCC1
STK528426
Synonyms: 4-chloro-N-[dimethyl(oxido)-lambda~6~-sulfanylidene]benzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)N=S(=O)(C)C
STK528427
Synonyms: N-[2-(2-phenyl-1H-imidazo[1,2-a]benzimidazol-1-yl)ethyl]cyclohexanamine
Smiles: C1CCC(CC1)NCCn1c(cn2c1nc1c2cccc1)c1ccccc1
STK528428
Synonyms: 3-({(E)-[4-(decyloxy)phenyl]methylidene}amino)-8-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: CCCCCCCCCCOc1ccc(cc1)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)OC
STK528429
Synonyms: methyl5-chloro-3-{[(4-ethylpiperazin-1-yl)acetyl]amino}-1H-indole-2-carboxylate
Smiles: CCN1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc(Cl)cc2)C(=O)OC
STK528430
Synonyms: N-[(E)-(4-nitrophenyl)methylidene]-9H-carbazol-3-amine
Smiles: [O-][N+](=O)c1ccc(cc1)/C=N/c1ccc2c(c1)c1ccccc1[nH]2
STK528432
Synonyms: 1-(4-fluorobenzyl)-3-naphthalen-1-yl-1-[4-(9H-thioxanthen-9-yl)phenyl]urea
Smiles: Fc1ccc(cc1)CN(C(=O)Nc1cccc2c1cccc2)c1ccc(cc1)C1c2ccccc2Sc2c1cccc2
STK528436
Synonyms: 3-{[(E)-(4-ethoxy-3-methoxyphenyl)methylidene]amino}-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: CCOc1ccc(cc1OC)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cccc1
STK528437
Synonyms: ethyl5-fluoro-3-{[(3-methylpiperidin-1-yl)acetyl]amino}-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCCC(C1)C)cc(cc2)F
STK528441
Synonyms: 1-(9H-carbazol-9-yl)-3-[4-(diphenylmethyl)piperazin-1-yl]propan-2-ol
Smiles: OC(Cn1c2ccccc2c2c1cccc2)CN1CCN(CC1)C(c1ccccc1)c1ccccc1
STK528442
Synonyms: 2-[(2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl)methyl]-1H-isoindole-1,3(2H)-dione
Smiles: CC1CC(C)(C)N(c2c1cccc2)CN1C(=O)c2c(C1=O)cccc2
STK528444
Synonyms: 3-{[(E)-(2,4-dihydroxyphenyl)methylidene]amino}-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Oc1ccc(c(c1)O)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)C
STK528446
Synonyms: methyl5-bromo-3-({[3-(ethoxycarbonyl)piperidin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: CCOC(=O)C1CCCN(C1)CC(=O)Nc1c([nH]c2c1cc(Br)cc2)C(=O)OC
STK528447
Synonyms: 2-(3,4-dichlorophenyl)-N-(4-methoxyphenyl)quinazolin-4-amine
Smiles: COc1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl
STK528448
Synonyms: methyl3-[(3,4-dihydroisoquinolin-2(1H)-ylacetyl)amino]-5-methyl-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCc3c(C1)cccc3)cc(cc2)C
STK528451
Synonyms: 2-(3,4-dichlorophenyl)-N-(2-methoxyphenyl)quinazolin-4-amine
Smiles: COc1ccccc1Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl
STK528452
Synonyms: methyl3-({[4-(4-nitrophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)[N+](=O)[O-])cccc2
STK528453
Synonyms: 3-({(E)-[3-(hydroxymethyl)-4-methoxyphenyl]methylidene}amino)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: OCc1cc(ccc1OC)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1
STK528454
Synonyms: N-(furan-2-ylmethyl)-6-(naphthalen-1-yloxy)hexan-1-amine
Smiles: C(CNCc1ccco1)CCCCOc1cccc2c1cccc2
STK528455
Synonyms: 4-[(E)-(hydroxyimino)methyl]-2,2-dimethyl-2,5-dihydro-1H-imidazol-1-ol
Smiles: O/N=C/C1=NC(N(C1)O)(C)C
STK528456
Synonyms: (3E)-3-[(2-chlorophenyl)imino]-2-(4-nitrophenyl)-2,3-dihydro-1H-inden-1-one
Smiles: O=C1C(c2ccc(cc2)[N+](=O)[O-])/C(=N\c2ccccc2Cl)/c2c1cccc2
STK528457
Synonyms: N-benzyl-2-oxo-1-oxaspiro[4.5]decane-4-carboxamide
Smiles: O=C(C1CC(=O)OC21CCCCC2)NCc1ccccc1
STK528458
Synonyms: 1-(4-tert-butylphenoxy)anthracene-9,10-dione
Smiles: O=C1c2c(cccc2C(=O)c2c1cccc2)Oc1ccc(cc1)C(C)(C)C
STK528460
Synonyms: N-phenyl-N-propyl-10H-phenothiazine-10-carboxamide
Smiles: CCCN(C(=O)N1c2ccccc2Sc2c1cccc2)c1ccccc1
STK528462
Synonyms: methyl5-bromo-3-({[4-(diphenylmethyl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C(c1ccccc1)c1ccccc1)cc(cc2)Br
STK528463
Synonyms: 8-{4-[2-(1,2-dimethyl-1H-indol-3-yl)-2-oxoethyl]piperazin-1-yl}-3-methyl-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)CC(=O)c1c2ccccc2n(c1C)C
STK528464
Synonyms: 3-{[(E)-(4-ethoxy-3-methoxyphenyl)methylidene]amino}-8-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: CCOc1ccc(cc1OC)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(cc1)OC
STK528465
Synonyms: 2,6-di-tert-butyl-4-[2-(2-hydroxy-5-nitrophenyl)-1H-benzimidazol-1-yl]phenol
Smiles: [O-][N+](=O)c1ccc(c(c1)c1nc2c(n1c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)cccc2)O
STK528466
Synonyms: methyl5-chloro-3-{[(3-methylpiperidin-1-yl)acetyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCCC(C1)C)cc(cc2)Cl
STK528467
Synonyms: 3,6-diamino-2-[(3,4-dichlorophenyl)carbonyl]-4-(4-hydroxyphenyl)thieno[2,3-b]pyridine-5-carbonitrile
Smiles: N#Cc1c(N)nc2c(c1c1ccc(cc1)O)c(N)c(s2)C(=O)c1ccc(c(c1)Cl)Cl
STK528470
Synonyms: dimethyl2-{2,2,8-trimethyl-1-[(2E)-3-(4-nitrophenyl)prop-2-enoyl]-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene}-1,3-dithiole-4,5-dicarboxylate
Smiles: COC(=O)C1=C(S/C(=C\2/c3cccc(c3N(C(C2=S)(C)C)C(=O)/C=C/c2ccc(cc2)[N+](=O)[O-])C)/S1)C(=O)OC
STK528471
Synonyms: N-dodecyl-N'-[4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,3-thiazol-2-yl]ethanediamide
Smiles: CCCCCCCCCCCCNC(=O)C(=O)Nc1scc(n1)C12CC3CC(C2)CC(C1)C3
STK528475
Synonyms: 5-[(1,3-benzothiazol-2-ylsulfanyl)acetyl]-5-methyl-4-(2-methylpropyl)dihydrofuran-2(3H)-one(non-preferredname)
Smiles: CC(CC1CC(=O)OC1(C)C(=O)CSc1nc2c(s1)cccc2)C
STK528476
Synonyms: 8-(heptylsulfanyl)-3-methyl-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCSc1nc2c(n1CCCc1ccccc1)c(=O)[nH]c(=O)n2C
STK528477
Synonyms: 4-{[(E)-(3-bromo-2-hydroxyphenyl)methylidene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: Oc1c(cccc1Br)/C=N/c1c(=O)n(n(c1C)C)c1ccccc1
STK528478
Synonyms: 4,4'-methanediylbis(1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazole-3-thione)
Smiles: Cc1c(Cc2c(C)n(n(c2=S)c2ccccc2)C)c(=S)n(n1C)c1ccccc1
STK528479
Synonyms: 1-[6-(2-chloro-5-methylphenoxy)hexyl]-4-(2-methoxyphenyl)piperazine
Smiles: COc1ccccc1N1CCN(CC1)CCCCCCOc1cc(C)ccc1Cl
STK528481
Synonyms: 3-methyl-8-(methylamino)-7-octyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCn1c(NC)nc2c1c(=O)[nH]c(=O)n2C
STK528483
Synonyms: 7-{4-[(3-chlorophenyl)carbonyl]piperazin-1-yl}-1-cyclopropyl-6-fluoro-N-(5-methyl-1,3-thiazol-2-yl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: Clc1cccc(c1)C(=O)N1CCN(CC1)c1cc2c(cc1F)c(=O)c(cn2C1CC1)C(=O)Nc1ncc(s1)C
STK528484
Synonyms: 2-[(3-cyano-4-ethyl-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl)sulfanyl]-2-phenylacetamide
Smiles: CCC1C(=C(SC(c2ccccc2)C(=O)N)NC2=C1C(=O)CC(C2)(C)C)C#N
STK528485
Synonyms: hexahydro-1H-benzimidazole-1,3(2H)-diol
Smiles: ON1CN(C2C1CCCC2)O
STK528488
Synonyms: (3E)-3-[2-(7-chloroquinolin-4-yl)hydrazinylidene]-5-nitro-1,3-dihydro-2H-indol-2-one
Smiles: Clc1ccc2c(c1)nccc2N/N=C\1/C(=O)Nc2c1cc(cc2)[N+](=O)[O-]
STK528489
Synonyms: 2-[(4-butoxy-3-chlorobenzyl)sulfanyl]ethanamine
Smiles: CCCCOc1ccc(cc1Cl)CSCCN
STK528492
Synonyms: decyl(2E)-3-[5-(4-chlorophenyl)furan-2-yl]-2-cyanoprop-2-enoate
Smiles: CCCCCCCCCCOC(=O)/C(=C/c1ccc(o1)c1ccc(cc1)Cl)/C#N
STK528495
Synonyms: 1-{(1Z)-1-[2-(6-bromo-4-phenylquinazolin-2-yl)hydrazinylidene]ethyl}naphthalen-2-ol
Smiles: Brc1ccc2c(c1)c(nc(n2)N/N=C(\c1c(O)ccc2c1cccc2)/C)c1ccccc1
STK528497
Synonyms: 3,3,6,6-tetramethyl-10-(3-nitrophenyl)-3,4,6,7,9,10-hexahydroacridine-1,8(2H,5H)-dione
Smiles: O=C1CC(C)(C)CC2=C1CC1=C(N2c2cccc(c2)[N+](=O)[O-])CC(CC1=O)(C)C
STK528498
Synonyms: 6-({(2Z)-3-(4-methoxyphenyl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}amino)hexanoicacid
Smiles: COc1ccc(cc1)/C=C(/C(=O)NCCCCCC(=O)O)\NC(=O)c1ccccc1
STK528499
Synonyms: ethyl3-{[N-(2,2-dimethoxyethyl)-N-methylglycyl]amino}-5-fluoro-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN(CC(OC)OC)C)cc(cc2)F
STK528500
Synonyms: (E)-1-(2,2-dimethyl-1-oxido-2H-imidazol-4-yl)-N-hydroxymethanimine
Smiles: O/N=C/C1=NC([N+](=C1)[O-])(C)C
STK528501
Synonyms: 3-{[(E)-(4-hydroxy-3,5-dimethoxyphenyl)methylidene]amino}-8-methyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: COc1cc(/C=N/n2c(=O)[nH]c3c(c2=O)[nH]c2c3cc(cc2)C)cc(c1O)OC
STK528502
Synonyms: 8-methyl-3-{[(E)-(4-methylphenyl)methylidene]amino}-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: Cc1ccc(cc1)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(cc1)C
STK528504
Synonyms: dimethyl[(4-methoxyphenyl)(phenylamino)methyl]phosphonate
Smiles: COP(=O)(C(c1ccc(cc1)OC)Nc1ccccc1)OC
STK528506
Synonyms: methyl10-hydroxy-11-(piperidin-1-yl)undecanoate
Smiles: COC(=O)CCCCCCCCC(CN1CCCCC1)O
STK528507
Synonyms: 3-{[(E)-(4-ethoxy-3-methoxyphenyl)methylidene]amino}-2-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: CCOc1ccc(cc1OC)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cccc1
STK528509
Synonyms: 7-hexadecyl-8-[(2-hydroxypropyl)sulfanyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCCCCCn1c(SCC(O)C)nc2c1c(=O)[nH]c(=O)n2C
STK528510
Synonyms: 1-amino-4-[(4-chlorophenyl)amino]-2-(pyrrolidin-1-yl)anthracene-9,10-dione
Smiles: Clc1ccc(cc1)Nc1cc(N2CCCC2)c(c2c1C(=O)c1ccccc1C2=O)N
STK528513
Synonyms: 3-{[(E)-(2-fluorophenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Fc1ccccc1/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1
STK528515
Synonyms: 4-{3-(2,4-dichlorophenyl)-5,6-dimethoxy-1-[(4-methylphenyl)sulfonyl]-1H-indol-2-yl}butan-2-one
Smiles: COc1cc2c(c3ccc(cc3Cl)Cl)c(n(c2cc1OC)S(=O)(=O)c1ccc(cc1)C)CCC(=O)C
STK528516
Synonyms: 3-{[(E)-(2-chlorophenyl)methylidene]amino}-8-methyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: Cc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1ccccc1Cl
STK528517
Synonyms: 2-(2-methylphenyl)-4-(4-nitrophenoxy)quinazoline
Smiles: Cc1ccccc1c1nc(Oc2ccc(cc2)[N+](=O)[O-])c2c(n1)cccc2
STK528518
Synonyms: 3-{[(E)-(4-hydroxyphenyl)methylidene]amino}-8-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc(cc1)O
STK528519
Synonyms: (2Z)-3-[(2,4-dichlorophenyl)amino]-2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C/Nc1ccc(cc1Cl)Cl)/c1scc(n1)c1ccc(c(c1)OC)OC
STK528521
Synonyms: (5E)-1-methyl-5-[1-(octadecylamino)ethylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCCCCCCCCCCCCCCCCCN/C(=C/1\C(=O)NC(=O)N(C1=O)C)/C
STK528522
Synonyms: 4-[(2E)-2-(furan-2-ylmethylidene)hydrazinyl]-2-(4-methoxyphenyl)quinazoline
Smiles: COc1ccc(cc1)c1nc(N/N=C/c2ccco2)c2c(n1)cccc2
STK528523
Synonyms: dimethyl[(4-bromophenyl)(phenylamino)methyl]phosphonate
Smiles: COP(=O)(C(c1ccc(cc1)Br)Nc1ccccc1)OC
STK528526
Synonyms: 3-amino-N-(4-bromophenyl)-4,6-bis(4-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide
Smiles: COc1ccc(cc1)c1cc(nc2c1c(N)c(s2)C(=O)Nc1ccc(cc1)Br)c1ccc(cc1)OC
STK528527
Synonyms: N-{3-methyl-1-oxo-1-[(tributylstannanyl)oxy]butan-2-yl}benzamide
Smiles: CCCC[Sn](OC(=O)C(C(C)C)NC(=O)c1ccccc1)(CCCC)CCCC
STK528528
Synonyms: N-(2-ethyl-4-oxoquinazolin-3(4H)-yl)-4-hydroxy-2-oxo-1-propyl-1,2-dihydroquinoline-3-carboxamide
Smiles: CCCn1c(=O)c(C(=O)Nn2c(CC)nc3c(c2=O)cccc3)c(c2c1cccc2)O
STK528532
Synonyms: N-{1-[1-(4-bromophenyl)-2-(2-butyl-2-hydroxyhexanoyl)hydrazinyl]-1-oxopropan-2-yl}-4-methylbenzenesulfonamide(non-preferredname)
Smiles: CCCCC(C(=O)NN(C(=O)C(NS(=O)(=O)c1ccc(cc1)C)C)c1ccc(cc1)Br)(CCCC)O
STK528533
Synonyms: 3-methyl-7-(3-methylbutyl)-8-(octylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCSc1nc2c(n1CCC(C)C)c(=O)[nH]c(=O)n2C
STK528535
Synonyms: 2-{2-methyl-1-oxo-1-[(trimethylstannanyl)oxy]propan-2-yl}-1H-isoindole-1,3(2H)-dione
Smiles: O=C(C(N1C(=O)c2c(C1=O)cccc2)(C)C)O[Sn](C)(C)C
STK528536
Synonyms: 4-[(2E)-2-(4-bromobenzylidene)hydrazinyl]-2-(2,4-dichlorophenyl)quinazoline
Smiles: Brc1ccc(cc1)/C=N/Nc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl
STK528537
Synonyms: (1R,3Z,5R,7E)-3,7-bis(3-nitrobenzylidene)bicyclo[3.3.1]nonane-2,6-dione
Smiles: O=C1[C@@H]2C[C@H](C/C/1=C\c1cccc(c1)[N+](=O)[O-])C(=O)/C(=C\c1cccc(c1)[N+](=O)[O-])/C2
STK528538
Synonyms: 7-(3-bromobenzyl)-8-(3,5-dimethyl-1H-pyrazol-1-yl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Brc1cccc(c1)Cn1c(nc2c1c(=O)n(C)c(=O)n2C)n1nc(cc1C)C
STK528540
Synonyms: 3-amino-1-(2-nitrophenyl)pyrrolidine-2,5-dione
Smiles: NC1CC(=O)N(C1=O)c1ccccc1[N+](=O)[O-]
STK528541
Synonyms: 3-(4-fluorobenzyl)-8-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)Cc1ccc(cc1)F
STK528543
Synonyms: 1-prop-2-en-1-yl-3-[(2Z)-1-propylpyridin-2(1H)-ylidene]thiourea
Smiles: CCCn1cccc/c/1=N/C(=S)NCC=C
STK528544
Synonyms: N-(2-hexyl-4-oxoquinazolin-3(4H)-yl)-4-hydroxy-1-methyl-2-oxo-1,2-dihydroquinoline-3-carboxamide
Smiles: CCCCCCc1nc2ccccc2c(=O)n1NC(=O)c1c(O)c2ccccc2n(c1=O)C
STK528545
Synonyms: 5-(dimethylsulfonio)-2,4,6-trioxo-1-phenylhexahydropyrimidin-5-ide
Smiles: O=C1NC(=O)[C-](C(=O)N1c1ccccc1)[S+](C)C
STK528546
Synonyms: 3-(4-fluorophenoxy)-2-methyl-N-(tetrahydrofuran-2-ylmethyl)propan-1-amine
Smiles: CC(COc1ccc(cc1)F)CNCC1CCCO1
STK528547
Synonyms: (2E)-2-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]-3-{[4-(propan-2-yl)phenyl]amino}prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)C(C)C)/c1scc(n1)c1ccc(cc1)F
STK528549
Synonyms: (7E)-3,4-diphenyl-7-(3,4,5-trimethoxybenzylidene)-4H-[1,3]thiazolo[2,3-c][1,2,4]triazin-6(7H)-one
Smiles: COc1cc(cc(c1OC)OC)/C=c\1/sc2=NN=C(C(n2c1=O)c1ccccc1)c1ccccc1
STK528551
Synonyms: N-(butan-2-yl)-1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CCC(NC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C)F)C
STK528553
Synonyms: (2E)-3-[(4-bromophenyl)amino]-2-[4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1)Br)/c1scc(n1)c1cc2ccccc2oc1=O
STK528554
Synonyms: methyl3-{[(4-benzylpiperazin-1-yl)acetyl]amino}-5-chloro-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)Cc1ccccc1)cc(cc2)Cl
STK528555
Synonyms: 2-(4-chlorophenyl)-N-(3,5-dichlorophenyl)quinazolin-4-amine
Smiles: Clc1ccc(cc1)c1nc(Nc2cc(Cl)cc(c2)Cl)c2c(n1)cccc2
STK528556
Synonyms: 3-[2-(morpholin-4-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: O=c1n(CCN2CCOCC2)cnc2c1[nH]c1c2cccc1
STK528557
Synonyms: hexyl2-({[3-(trifluoromethyl)phenyl]carbamoyl}amino)benzoate
Smiles: CCCCCCOC(=O)c1ccccc1NC(=O)Nc1cccc(c1)C(F)(F)F
STK528558
Synonyms: (2E,2'E)-N,N'-(1,3-dimethyl-2-oxoimidazolidine-4,5-diyl)bis(2-benzylidenehydrazinecarboxamide)
Smiles: CN1C(NC(=O)N/N=C/c2ccccc2)C(N(C1=O)C)NC(=O)N/N=C/c1ccccc1
STK528559
Synonyms: 2,4-dichloro-6-{(E)-[2-(pentafluorophenyl)hydrazinylidene]methyl}phenol
Smiles: Clc1cc(/C=N/Nc2c(F)c(F)c(c(c2F)F)F)c(c(c1)Cl)O
STK528560
Synonyms: 6-[(E)-(2-{[(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)amino]acetyl}hydrazinylidene)methyl]-2,3-dimethoxybenzoicacid(non-preferredname)
Smiles: COc1ccc(c(c1OC)C(=O)O)/C=N/NC(=O)CNC(=O)c1ccc2c(c1)OCCO2
STK528562
Synonyms: 3-[2-(4-bromophenyl)-1H-imidazo[1,2-a]benzimidazol-1-yl]-N-(propan-2-yl)propan-1-amine
Smiles: CC(NCCCn1c(cn2c1nc1c2cccc1)c1ccc(cc1)Br)C
STK528563
Synonyms: 4-(thiomorpholin-4-yl)-5H-pyrimido[5,4-b]indole
Smiles: S1CCN(CC1)c1ncnc2c1[nH]c1c2cccc1
STK528565
Synonyms: 3-{[(E)-(4-ethoxy-3-methoxyphenyl)methylidene]amino}-8-methyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: CCOc1ccc(cc1OC)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(cc1)C
STK528567
Synonyms: 2-amino-4-ethyl-6-(propylsulfanyl)pyridine-3,5-dicarbonitrile
Smiles: CCCSc1nc(N)c(c(c1C#N)CC)C#N
STK528568
Synonyms: 8-methoxy-3-{[(E)-(4-methylphenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc(cc1)C
STK528569
Synonyms: 2-(4-chlorophenyl)-4-{(2E)-2-[1-(4-chlorophenyl)ethylidene]hydrazinyl}quinazoline
Smiles: Clc1ccc(cc1)/C(=N/Nc1nc(nc2c1cccc2)c1ccc(cc1)Cl)/C
STK528570
Synonyms: ethyl4-[(5E)-5-(2,4-dimethoxybenzylidene)-2,4,6-trioxotetrahydropyrimidin-1(2H)-yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2ccc(cc2OC)OC)/C1=O
STK528572
Synonyms: N'-[hydroxy(diphenyl)acetyl]-5-methyl-N-phenylthiophene-3-carbohydrazide
Smiles: Cc1scc(c1)C(=O)N(c1ccccc1)NC(=O)C(c1ccccc1)(c1ccccc1)O
STK528573
Synonyms: 6-methyl-3-(trimethylstannanyl)pyrimidine-2,4(1H,3H)-dione
Smiles: Cc1cc(=O)n(c(=O)[nH]1)[Sn](C)(C)C
STK528575
Synonyms: benzylN-{(2E)-3-(4-bromophenyl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}leucinate
Smiles: Brc1ccc(cc1)/C=C(\C(=O)NC(C(=O)OCc1ccccc1)CC(C)C)/NC(=O)c1ccccc1
STK528576
Synonyms: ethyl4-(3-bromo-2-hydroxyphenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: CC1=C(C(NC(=O)N1C)c1cccc(c1O)Br)C(=O)OCC
STK528577
Synonyms: 2-(2,4-dichlorophenyl)-4-[(2E)-2-(2,4-dimethoxybenzylidene)hydrazinyl]quinazoline
Smiles: COc1cc(OC)ccc1/C=N/Nc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl
STK528580
Synonyms: ethyl2-({4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl}amino)-3,3,3-trifluoro-N-(furan-2-ylcarbonyl)alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(NC(=O)c1ccco1)Nc1ccc(cc1)S(=O)(=O)Nc1cc(OC)nc(n1)OC
STK528582
Synonyms: (2E)-2-cyano-2-(6,7,8,9,9a,10,11,12,13,14-decahydro-2H-benzimidazo[2,1-e]acridin-2-ylidene)ethanamide
Smiles: N#C/C(=c\1/ccc2=NC34N(c2c1)C1=C(CCCC1)CC4CCCC3)/C(=O)N
STK528583
Synonyms: 2-(2,4-dichlorophenyl)-N-(4-methylphenyl)quinazolin-4-amine
Smiles: Cc1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl
STK528584
Synonyms: 2-(4-ethylpiperazin-1-yl)-1-(5-methoxy-1,2-dimethyl-1H-indol-3-yl)ethanone
Smiles: CCN1CCN(CC1)CC(=O)c1c(C)n(c2c1cc(OC)cc2)C
STK528585
Synonyms: (2Z)-2-(4,5-dimethoxy-2-nitrophenyl)-3-(naphthalen-1-yl)prop-2-enenitrile
Smiles: N#C/C(=C\c1cccc2c1cccc2)/c1cc(OC)c(cc1[N+](=O)[O-])OC
STK528587
Synonyms: 3-chloro-7-(piperidin-1-yl)-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione
Smiles: Clc1ccc2c(c1)oc1c([nH]2)c2c(=O)c3ccccc3c(=O)c2c(c1)N1CCCCC1
STK528589
Synonyms: 3-[4-(9H-fluoren-2-yl)-1,3-thiazol-2-yl]-2-oxo-2H-chromen-7-ylacetate
Smiles: CC(=O)Oc1ccc2c(c1)oc(=O)c(c2)c1scc(n1)c1ccc2c(c1)Cc1c2cccc1
STK528590
Synonyms: 1-ethyl-6-fluoro-N-heptyl-7-(4-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CCCCCCCNC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C)F
STK528591
Synonyms: N-{4-[3-(4-methoxyphenyl)-4-oxo-1,2,3,4-tetrahydroquinazolin-2-yl]phenyl}acetamide
Smiles: COc1ccc(cc1)N1C(Nc2c(C1=O)cccc2)c1ccc(cc1)NC(=O)C
STK528593
Synonyms: 3-{[(E)-(3-bromo-2-hydroxyphenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Brc1cccc(c1O)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1
STK528595
Synonyms: methyl3-{[(4-benzylpiperazin-1-yl)acetyl]amino}-5-methyl-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)Cc1ccccc1)cc(cc2)C
STK528596
Synonyms: 5-{2-ethoxy-5-[(1,3,3-trimethyl-6-azabicyclo[3.2.1]oct-6-yl)sulfonyl]phenyl}-1-methyl-3-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one
Smiles: CCCc1nn(c2c1nc([nH]c2=O)c1cc(ccc1OCC)S(=O)(=O)N1CC2(CC1CC(C2)(C)C)C)C
STK528598
Synonyms: 8-[(2-hydroxyethyl)sulfanyl]-7-[2-hydroxy-3-(2-methylphenoxy)propyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: OCCSc1nc2c(n1CC(COc1ccccc1C)O)c(=O)[nH]c(=O)n2C
STK528599
Synonyms: 2,2'-{[4-(2-chloroethyl)phenyl]methanediyl}bis(5,5-dimethylcyclohexane-1,3-dione)
Smiles: ClCCc1ccc(cc1)C(C1C(=O)CC(CC1=O)(C)C)C1C(=O)CC(CC1=O)(C)C
STK528601
Synonyms: N-(4-phenyl-1,3-thiazol-2-yl)-N'-undecylethanediamide
Smiles: CCCCCCCCCCCNC(=O)C(=O)Nc1scc(n1)c1ccccc1
STK528603
Synonyms: (2Z)-2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-[(4-chloro-2,5-dimethoxyphenyl)amino]prop-2-enenitrile
Smiles: N#C/C(=C/Nc1cc(OC)c(cc1OC)Cl)/c1scc(n1)c1cccc(c1)Br
STK528606
Synonyms: (2Z)-3-[(4-chloro-2,5-dimethoxyphenyl)amino]-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C/Nc1cc(OC)c(cc1OC)Cl)/c1scc(n1)c1ccc(cc1)C
STK528608
Synonyms: N-[3-(diethylamino)propyl]-1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CCN(CCCNC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C)F)CC
STK528609
Synonyms: 2-(1-methyl-5-oxo-2-thioxoimidazolidin-4-yl)acetamide
Smiles: CN1C(=O)C(NC1=S)CC(=O)N
STK528610
Synonyms: 4-[(2E)-2-(4-chlorobenzylidene)hydrazinyl][1,2,4]triazolo[4,3-a]quinoxaline
Smiles: Clc1ccc(cc1)/C=N/Nc1nc2ccccc2n2c1nnc2
STK528613
Synonyms: 3,4-dichloro-N-[(1Z)-8-ethoxy-4,4-dimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-ylidene]aniline
Smiles: CCOc1ccc2c(c1)c1/c(=N/c3ccc(c(c3)Cl)Cl)/ssc1C(N2)(C)C
STK528614
Synonyms: 1,2,3,4,9,9-hexachloro-7-(dibutylcarbamoyl)-5-methyl-1,4,4a,5,6,7,8,8a-octahydro-1,4-methanonaphthalene-6-carboxylicacid
Smiles: CCCCN(C(=O)C1CC2C(C(C1C(=O)O)C)C1(C(C2(Cl)C(=C1Cl)Cl)(Cl)Cl)Cl)CCCC
STK528615
Synonyms: 8-methyl-4-(4-methylpiperazin-1-yl)-5H-pyrimido[5,4-b]indole
Smiles: CN1CCN(CC1)c1ncnc2c1[nH]c1c2cc(cc1)C
STK528617
Synonyms: N-[4-(1,3-dioxo-2,3-dihydro-1H-inden-2-yl)phenyl]butanamide
Smiles: CCCC(=O)Nc1ccc(cc1)C1C(=O)c2c(C1=O)cccc2
STK528619
Synonyms: 3-{[(E)-(2-hydroxy-3-methoxyphenyl)methylidene]amino}-8-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cccc(c1O)OC
STK528620
Synonyms: 3,7-bis(benzylsulfanyl)-1,5-diphenyl-1H,5H-[1,2,4]triazolo[1,2-a][1,2,4]triazole
Smiles: c1ccc(cc1)C1N=C(N2N1C(=NC2c1ccccc1)SCc1ccccc1)SCc1ccccc1
STK528622
Synonyms: 4-[(2E)-2-(2-chlorobenzylidene)hydrazinyl]-2-(2-chlorophenyl)quinazoline
Smiles: Clc1ccccc1/C=N/Nc1nc(nc2c1cccc2)c1ccccc1Cl
STK528623
Synonyms: (2E)-5,6-diphenyl-2-(3,4,5-trimethoxybenzylidene)imidazo[2,1-b][1,3]thiazol-3(2H)-one
Smiles: COc1cc(cc(c1OC)OC)/C=c\1/sc2n(c1=O)c(c(n2)c1ccccc1)c1ccccc1
STK528625
Synonyms: 3-{[(E)-(2-hydroxy-5-methoxyphenyl)methylidene]amino}-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc(c(c1)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)C)O
STK528627
Synonyms: N'-(7-butyl-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)formichydrazide
Smiles: CCCCn1c(NNC=O)nc2c1c(=O)[nH]c(=O)n2C
STK528629
Synonyms: 4-methyl-N-[(1E)-1-[4-(methylsulfanyl)phenyl]-3-oxo-3-{[3-(trifluoromethyl)phenyl]amino}prop-1-en-2-yl]benzamide
Smiles: CSc1ccc(cc1)/C=C(\C(=O)Nc1cccc(c1)C(F)(F)F)/NC(=O)c1ccc(cc1)C
STK528630
Synonyms: (4E)-4-{[5-(2-nitrophenyl)furan-2-yl]methylidene}-2-phenyl-5-[(phenylsulfanyl)methyl]-2,4-dihydro-3H-pyrazol-3-one
Smiles: O=C1N(N=C(/C/1=C\c1ccc(o1)c1ccccc1[N+](=O)[O-])CSc1ccccc1)c1ccccc1
STK528631
Synonyms: diphenyl[(4-methoxyphenyl)(phenylamino)methyl]phosphonate
Smiles: COc1ccc(cc1)C(P(=O)(Oc1ccccc1)Oc1ccccc1)Nc1ccccc1
STK528632
Synonyms: 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-N-[2-(morpholin-4-yl)ethyl]-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CCn1cc(C(=O)NCCN2CCOCC2)c(=O)c2c1cc(N1CCN(CC1)C)c(c2)F
STK528633
Synonyms: 2-methyl-3-({(E)-[4-(prop-2-en-1-yloxy)phenyl]methylidene}amino)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: C=CCOc1ccc(cc1)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cccc1
STK528635
Synonyms: 8-methoxy-2-methyl-3-{[(E)-(4-methylphenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)c1nc(C)n(c(=O)c1[nH]2)/N=C/c1ccc(cc1)C
STK528636
Synonyms: (7-amino-2,2,4-trimethyl-4-phenyl-3,4-dihydroquinolin-1(2H)-yl)[4-(propan-2-yl)phenyl]methanone
Smiles: Nc1ccc2c(c1)N(C(=O)c1ccc(cc1)C(C)C)C(CC2(C)c1ccccc1)(C)C
STK528637
Synonyms: 2-[(6-chloro-1,3-benzoxazol-2-yl)sulfanyl]-N,N-dimethylacetamide
Smiles: Clc1ccc2c(c1)oc(n2)SCC(=O)N(C)C
STK528638
Synonyms: 1-(azepan-1-yl)-3-(diphenylamino)propan-2-ol
Smiles: OC(CN1CCCCCC1)CN(c1ccccc1)c1ccccc1
STK528639
Synonyms: 1-(4'-nitrobiphenyl-4-yl)-3-[3-(trifluoromethyl)phenyl]urea
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)Nc1ccc(cc1)c1ccc(cc1)[N+](=O)[O-]
STK528641
Synonyms: methyl5-chloro-3-{[(2-ethylpiperidin-1-yl)acetyl]amino}-1H-indole-2-carboxylate
Smiles: CCC1CCCCN1CC(=O)Nc1c([nH]c2c1cc(Cl)cc2)C(=O)OC
STK528643
Synonyms: 2-(3-{[(4Z)-4-(4-hydroxy-3-methoxybenzylidene)-5-oxo-1-(2,4,6-trichlorophenyl)-4,5-dihydro-1H-pyrazol-3-yl]carbamoyl}phenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylicacid
Smiles: COc1cc(ccc1O)/C=C\1/C(=NN(C1=O)c1c(Cl)cc(cc1Cl)Cl)NC(=O)c1cccc(c1)N1C(=O)c2c(C1=O)cc(cc2)C(=O)O
STK528644
Synonyms: N,2-bis[2-(3,4-dimethoxyphenyl)ethyl]-1,3-dioxo-2,3-dihydro-1H-benzo[de]isoquinoline-6-carboxamide
Smiles: COc1ccc(cc1OC)CCNC(=O)c1ccc2c3c1cccc3c(=O)n(c2=O)CCc1ccc(c(c1)OC)OC
STK528645
Synonyms: 7-methyl-6H-[1,2,5]oxadiazolo[3,4-e]indole
Smiles: Cc1[nH]c2c(c1)c1nonc1cc2
STK528646
Synonyms: 2-(4-methylphenyl)-1-[2-(piperidin-1-yl)ethyl]-1H-imidazo[1,2-a]benzimidazole
Smiles: Cc1ccc(cc1)c1cn2c(n1CCN1CCCCC1)nc1c2cccc1
STK528648
Synonyms: ethyl3-{(E)-[4-(4-fluorophenyl)piperazin-1-yl]diazenyl}-5-methoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1/N=N/N1CCN(CC1)c1ccc(cc1)F)cc(cc2)OC
STK528650
Synonyms: 3-[2-(piperazin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: O=c1n(CCN2CCNCC2)cnc2c1[nH]c1c2cccc1
STK528651
Synonyms: N-(4-bromophenyl)-2-(4-chlorophenyl)quinazolin-4-amine
Smiles: Clc1ccc(cc1)c1nc(Nc2ccc(cc2)Br)c2c(n1)cccc2
STK528653
Synonyms: 3-{[(E)-(3-hydroxy-4-methoxyphenyl)methylidene]amino}-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc(cc1O)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)C
STK528654
Synonyms: 3-(hydroxymethyl)-1,3-benzoxazole-2(3H)-thione
Smiles: OCn1c(=S)oc2c1cccc2
STK528655
Synonyms: 1-(1,2-dimethyl-1H-indol-3-yl)-2-[4-(9H-fluoren-9-yl)piperazin-1-yl]ethanone
Smiles: O=C(c1c2ccccc2n(c1C)C)CN1CCN(CC1)C1c2ccccc2c2c1cccc2
STK528656
Synonyms: (3E)-2-(diphenylacetyl)-3-{(2E)-[(2E)-3-(furan-2-yl)prop-2-en-1-ylidene]hydrazinylidene}-2,3-dihydro-1H-inden-1-one
Smiles: O=C(C1C(=O)c2c(/C/1=N/N=C/C=C/c1ccco1)cccc2)C(c1ccccc1)c1ccccc1
STK528657
Synonyms: 5-bromo-2-iodo-N-[2-(pyridin-4-yl)-1,3-benzoxazol-5-yl]benzamide
Smiles: Brc1ccc(c(c1)C(=O)Nc1ccc2c(c1)nc(o2)c1ccncc1)I
STK528658
Synonyms: (2E)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-[(2-iodophenyl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccccc1I)/c1scc(n1)c1ccc2c(c1)OCO2
STK528659
Synonyms: 2-(butylsulfanyl)-5-(4,5-dimethoxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)-6-hydroxy-3-methylpyrimidin-4(3H)-one
Smiles: CCCCSc1nc(O)c(c(=O)n1C)C1OC(=O)c2c1ccc(c2OC)OC
STK528660
Synonyms: (2E)-2-[4-(heptyloxy)benzylidene]-N-(4-propoxybenzyl)hydrazinecarbothioamide
Smiles: CCCCCCCOc1ccc(cc1)/C=N/NC(=S)NCc1ccc(cc1)OCCC
STK528661
Synonyms: 10-[3-(dibutylamino)-2-hydroxypropyl]acridin-9(10H)-one
Smiles: CCCCN(CC(Cn1c2ccccc2c(=O)c2c1cccc2)O)CCCC
STK528662
Synonyms: 1-[4-(4-fluorophenoxy)butyl]-3,5-dimethylpiperidine
Smiles: CC1CN(CCCCOc2ccc(cc2)F)CC(C1)C
STK528664
Synonyms: 8-methyl-3-(pyridin-2-ylmethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Cc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)Cc1ccccn1
STK528666
Synonyms: 2-phenyl-1-[2-(pyrrolidin-1-yl)ethyl]-1H-imidazo[1,2-a]benzimidazole
Smiles: c1ccc(cc1)c1cn2c(n1CCN1CCCC1)nc1c2cccc1
STK528667
Synonyms: 8-[(3-chloro-2-hydroxypropyl)sulfanyl]-7-hexadecyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCCCCCn1c(SCC(CCl)O)nc2c1c(=O)[nH]c(=O)n2C
STK528669
Synonyms: ethyl(2-{[(1-ethyl-4-hydroxy-2-oxo-1,2-dihydroquinolin-3-yl)carbonyl]amino}-1,3-thiazol-4-yl)acetate
Smiles: CCOC(=O)Cc1csc(n1)NC(=O)c1c(O)c2ccccc2n(c1=O)CC
STK528670
Synonyms: 8-[(2E)-2-(2-hydroxybenzylidene)hydrazinyl]-3-methyl-7-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CCn1c(N/N=C/c2ccccc2O)nc2c1c(=O)[nH]c(=O)n2C)C
STK528671
Synonyms: 2-(2,4-dichlorophenyl)-N,N-diethylquinazolin-4-amine
Smiles: CCN(c1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl)CC
STK528672
Synonyms: dipropan-2-yl{(E)-amino[2-(4-nitrophenyl)hydrazinylidene]methyl}phosphonate
Smiles: CC(OP(=O)(/C(=N/Nc1ccc(cc1)[N+](=O)[O-])/N)OC(C)C)C
STK528673
Synonyms: N-tert-butyl-2-{[(1S,2S)-2-phenylcyclopropyl]carbonyl}hydrazinecarbothioamide
Smiles: O=C([C@H]1C[C@@H]1c1ccccc1)NNC(=S)NC(C)(C)C
STK528676
Synonyms: 7-hexadecyl-3-methyl-8-(morpholin-4-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCOCC1
STK528677
Synonyms: 7-heptyl-3-methyl-8-(piperazin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCNCC1
STK528678
Synonyms: 2-(3,4-dichlorophenyl)-N,N-diethylquinazolin-4-amine
Smiles: CCN(c1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl)CC
STK528680
Synonyms: 4-(3,4-dimethylpyridinium-1-yl)-2-oxo-5-{(E)-[2-(pyridin-4-ylcarbonyl)hydrazinylidene]methyl}-1,3-thiazol-3-ide
Smiles: O=c1sc(c([n-]1)[n+]1ccc(c(c1)C)C)/C=N/NC(=O)c1ccncc1
STK528682
Synonyms: 3-{[(tributylstannanyl)oxy]carbonyl}pyridine
Smiles: CCCC[Sn](OC(=O)c1cccnc1)(CCCC)CCCC
STK528683
Synonyms: 1-(2-methylprop-2-en-1-yl)pyrrolidine-2,5-dione
Smiles: CC(=C)CN1C(=O)CCC1=O
STK528684
Synonyms: 3-imino-1-methyl-5-phenyl-7-propyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile
Smiles: CCCC1C2(C)OC(=N)C(C1(C#N)C#N)(C(O2)c1ccccc1)C#N
STK528685
Synonyms: 8-methoxy-3-{[(E)-(2,3,4-trimethoxyphenyl)methylidene]amino}-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: COc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1ccc(c(c1OC)OC)OC
STK528686
Synonyms: 8-(benzylamino)-7-hexadecyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCCCCCn1c(NCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C
STK528687
Synonyms: 1-[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-3-(4-chlorophenyl)-2-imino-5-methylimidazolidin-4-one
Smiles: Clc1ccc(cc1)N1C(=O)C(N(C1=N)c1nc(nc(n1)N(C)C)N(C)C)C
STK528688
Synonyms: ethyl5-methoxy-3-{[(3-methylpiperidin-1-yl)acetyl]amino}-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCCC(C1)C)cc(cc2)OC
STK528689
Synonyms: N-{4-tert-butyl-1-[1-(2,6-dimethylphenyl)-1H-tetrazol-5-yl]cyclohexyl}-N-nitroso-3-(trifluoromethyl)aniline
Smiles: O=NN(C1(CCC(CC1)C(C)(C)C)c1nnnn1c1c(C)cccc1C)c1cccc(c1)C(F)(F)F
STK528690
Synonyms: 8-[(4-chlorobenzyl)sulfanyl]-7-hexadecyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCCCCCn1c(SCc2ccc(cc2)Cl)nc2c1c(=O)[nH]c(=O)n2C
STK528691
Synonyms: 8-bromo-3-({(E)-[4-(prop-2-en-1-yloxy)phenyl]methylidene}amino)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: C=CCOc1ccc(cc1)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)Br
STK528692
Synonyms: ethyl2-(1,3-benzothiazol-2-ylamino)-3,3,3-trifluoro-N-(pyridin-3-ylcarbonyl)alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(NC(=O)c1cccnc1)Nc1nc2c(s1)cccc2
STK528693
Synonyms: 8-chloro-3-[2-(2-methoxyphenyl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccccc1CCn1cnc2c(c1=O)[nH]c1c2cc(cc1)Cl
STK528694
Synonyms: N-(4-nitrophenyl)-N'-[(4Z)-2-oxo-1,2-dihydro-4H-3,1-benzoxazin-4-ylidene]acetohydrazide
Smiles: CC(=O)N(c1ccc(cc1)[N+](=O)[O-])/N=c/1\oc(=O)[nH]c2c1cccc2
STK528698
Synonyms: 2-(2,4-dichlorophenyl)-4-[(2E)-2-(3-methoxybenzylidene)hydrazinyl]quinazoline
Smiles: COc1cccc(c1)/C=N/Nc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl
STK528699
Synonyms: 4-[(2E)-2-(2-chlorobenzylidene)hydrazinyl]-2-(4-chlorophenyl)quinazoline
Smiles: Clc1ccc(cc1)c1nc(N/N=C/c2ccccc2Cl)c2c(n1)cccc2
STK528700
Synonyms: 2-hydroxy-2,2-bis(4-methoxyphenyl)-N'-[(1E,2E)-3-phenylprop-2-en-1-ylidene]acetohydrazide
Smiles: COc1ccc(cc1)C(c1ccc(cc1)OC)(C(=O)N/N=C/C=C/c1ccccc1)O
STK528701
Synonyms: 2,2'-{[3-(hydroxymethyl)-4-methoxyphenyl]methanediyl}bis(5,5-dimethylcyclohexane-1,3-dione)
Smiles: OCc1cc(ccc1OC)C(C1C(=O)CC(CC1=O)(C)C)C1C(=O)CC(CC1=O)(C)C
STK528702
Synonyms: 4-(acryloylamino)-4-methyltetrahydrothiophene-3-sulfonicacid1,1-dioxide
Smiles: C=CC(=O)NC1(C)CS(=O)(=O)CC1S(=O)(=O)O
STK528703
Synonyms: 4-{[3-(methylamino)-3-oxopropanoyl]amino}benzoicacid
Smiles: CNC(=O)CC(=O)Nc1ccc(cc1)C(=O)O
STK528704
Synonyms: 3-methyl-8-[(2E)-2-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]-7-pentyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCn1c(N/N=C\2/C(=O)Nc3c2cccc3)nc2c1c(=O)[nH]c(=O)n2C
STK528705
Synonyms: (2E)-2-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-3-[(2-methyl-4-nitrophenyl)amino]prop-2-enenitrile
Smiles: CCOc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccc(cc1C)[N+](=O)[O-])/C#N
STK528706
Synonyms: 1,7-dibenzyl-3-methyl-8-[(4-methylbenzyl)amino]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1ccc(cc1)CNc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)Cc1ccccc1
STK528707
Synonyms: 8-(diethylamino)-3-methyl-7-nonyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N(CC)CC
STK528708
Synonyms: 3,3'-({3-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-4-methoxyphenyl}methanediyl)bis(4-hydroxy-2H-chromen-2-one)
Smiles: COc1ccc(cc1Cn1nc(c(c1C)[N+](=O)[O-])C)C(c1c(=O)oc2c(c1O)cccc2)c1c(=O)oc2c(c1O)cccc2
STK528710
Synonyms: 4-(4-methylpyridinium-1-yl)-2-oxo-5-{(E)-[2-(phenylcarbonyl)hydrazinylidene]methyl}-1,3-thiazol-3-ide
Smiles: Cc1cc[n+](cc1)c1[n-]c(=O)sc1/C=N/NC(=O)c1ccccc1
STK528712
Synonyms: methyl3-({[4-(4-fluorophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)F)cccc2
STK528713
Synonyms: ethyl4-(4-hydroxy-3-methoxyphenyl)-6-{[4-(3-methoxyphenyl)-3-methylpiperazin-1-yl]methyl}-1-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: CCOC(=O)C1=C(CN2CCN(C(C2)C)c2cccc(c2)OC)N(C(=O)NC1c1ccc(c(c1)OC)O)C
STK528714
Synonyms: 1-[2-(2,6-dimethoxyphenoxy)ethyl]-4-[3-(trifluoromethyl)phenyl]piperazine
Smiles: COc1cccc(c1OCCN1CCN(CC1)c1cccc(c1)C(F)(F)F)OC
STK528715
Synonyms: 3,4-dichloro-1-{6-oxo-6-[(trimethylstannanyl)oxy]hexyl}-1H-pyrrole-2,5-dione
Smiles: O=C(O[Sn](C)(C)C)CCCCCN1C(=O)C(=C(C1=O)Cl)Cl
STK528717
Synonyms: 2-(3,4-dichlorophenyl)-4-(piperidin-1-yl)quinazoline
Smiles: Clc1ccc(cc1Cl)c1nc(N2CCCCC2)c2c(n1)cccc2
STK528718
Synonyms: ethyl5-methoxy-3-({[(3R)-4-(3-methoxyphenyl)-3-methylpiperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(C(C1)C)c1cccc(c1)OC)cc(cc2)OC
STK528719
Synonyms: ethyl3,3,3-trifluoro-2-[(2-fluorophenyl)amino]-N-(pyridin-3-ylcarbonyl)alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(Nc1ccccc1F)NC(=O)c1cccnc1
STK528720
Synonyms: N-decyl-N'-[4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,3-thiazol-2-yl]ethanediamide
Smiles: CCCCCCCCCCNC(=O)C(=O)Nc1scc(n1)C12CC3CC(C2)CC(C1)C3
STK528722
Synonyms: 8,8,10,10-tetramethyl-2-{2-[2-(pyridin-3-yl)piperidin-1-yl]ethyl}-8,9,10,11-tetrahydropyrido[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles: CC1(C)Cc2c3c(sc2C(N1)(C)C)ncn1c3nc(n1)CCN1CCCCC1c1cccnc1
STK528724
Synonyms: 8-(dimethylamino)-3-methyl-7-octyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N(C)C
STK528729
Synonyms: (3Z)-3-[(2E)-(5,5-dimethyl-4-oxo-1,3-thiazolidin-2-ylidene)hydrazinylidene]-1,3-dihydro-2H-indol-2-one
Smiles: O=C1Nc2c(/C/1=N/N=C/1\NC(=O)C(S1)(C)C)cccc2
STK528731
Synonyms: N-(2-{1-(4-bromophenyl)-2-[hydroxy(diphenyl)acetyl]hydrazinyl}-2-oxoethyl)-4-methylbenzenesulfonamide(non-preferredname)
Smiles: Brc1ccc(cc1)N(C(=O)CNS(=O)(=O)c1ccc(cc1)C)NC(=O)C(c1ccccc1)(c1ccccc1)O
STK528732
Synonyms: methylN-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-{[(2,4-dichlorophenyl)carbonyl]amino}-3,3,3-trifluoroalaninate
Smiles: N#Cc1c(sc2c1CCCC2)NC(C(F)(F)F)(C(=O)OC)NC(=O)c1ccc(cc1Cl)Cl
STK528735
Synonyms: N-{4-[(1E)-3-oxo-2-(phenylcarbonyl)but-1-en-1-yl]phenyl}propanamide
Smiles: CCC(=O)Nc1ccc(cc1)/C=C(/C(=O)c1ccccc1)\C(=O)C
STK528737
Synonyms: 7-[4-(dimethylamino)phenyl]-6H,7H,8H-pyrano[3,2-c:5,6-c']dichromene-6,8-dione
Smiles: O=c1oc2ccccc2c2c1C(c1ccc(cc1)N(C)C)c1c(=O)oc3c(c1O2)cccc3
STK528740
Synonyms: methyl3-({3-[4-(2-fluorophenyl)piperazin-1-yl]propanoyl}amino)-5-methyl-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1ccccc1F)cc(cc2)C
STK528741
Synonyms: (2E)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-3-[(3,4-dichlorophenyl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(c(c1)Cl)Cl)/c1scc(n1)c1ccc(cc1)Cl
STK528742
Synonyms: methyl{[6-amino-4-(4-bromophenyl)-3,5-dicyanopyridin-2-yl]sulfanyl}acetate
Smiles: COC(=O)CSc1nc(N)c(c(c1C#N)c1ccc(cc1)Br)C#N
STK528743
Synonyms: 3-(biphenyl-4-yl)-5-(5-methylfuran-2-yl)-1-phenyl-4,5-dihydro-1H-pyrazole
Smiles: Cc1ccc(o1)C1CC(=NN1c1ccccc1)c1ccc(cc1)c1ccccc1
STK528744
Synonyms: 8-{(2E)-2-[1-(2-hydroxyphenyl)ethylidene]hydrazinyl}-3-methyl-7-nonyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCn1c(N/N=C(/c2ccccc2O)\C)nc2c1c(=O)[nH]c(=O)n2C
STK528745
Synonyms: 3-{[(E)-(2-fluorophenyl)methylidene]amino}-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Cc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccccc1F
STK528746
Synonyms: 3-[2-(dipropan-2-ylamino)ethyl]-8-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)CCN(C(C)C)C(C)C
STK528748
Synonyms: 2-(2,4-dichlorophenyl)-4-(4-methylpiperazin-1-yl)quinazoline
Smiles: CN1CCN(CC1)c1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl
STK528749
Synonyms: N-(2-chlorophenyl)-2-(3,4-dichlorophenyl)quinazolin-4-amine
Smiles: Clc1cc(ccc1Cl)c1nc(Nc2ccccc2Cl)c2c(n1)cccc2
STK528750
Synonyms: 4-oxo-2-[(2-oxo-2-phenylethyl)sulfanyl]-3-azaspiro[5.5]undec-1-ene-1,5-dicarbonitrile
Smiles: N#CC1=C(SCC(=O)c2ccccc2)NC(=O)C(C21CCCCC2)C#N
STK528751
Synonyms: 7-hexyl-3-methyl-8-[(2E)-2-(4-nitrobenzylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCn1c(N/N=C/c2ccc(cc2)[N+](=O)[O-])nc2c1c(=O)[nH]c(=O)n2C
STK528752
Synonyms: diethyl1-(3-chlorophenyl)-2,6-dimethyl-4-(4-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
Smiles: CCOC(=O)C1=C(C)N(C(=C(C1c1ccc(cc1)[N+](=O)[O-])C(=O)OCC)C)c1cccc(c1)Cl
STK528754
Synonyms: 3-methyl-8-(morpholin-4-yl)-7-(propan-2-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=c1[nH]c(=O)n(c2c1n(C(C)C)c(n2)N1CCOCC1)C
STK528755
Synonyms: 2-bromo-6-{(E)-[2-(pentafluorophenyl)hydrazinylidene]methyl}phenol
Smiles: Brc1cccc(c1O)/C=N/Nc1c(F)c(F)c(c(c1F)F)F
STK528756
Synonyms: N-{4-tert-butyl-1-[1-(2,6-dimethylphenyl)-1H-tetrazol-5-yl]cyclohexyl}-4-chloro-N-nitrosoaniline
Smiles: O=NN(C1(CCC(CC1)C(C)(C)C)c1nnnn1c1c(C)cccc1C)c1ccc(cc1)Cl
STK528757
Synonyms: dibutyl2,2'-(2-oxo-1H-benzimidazole-1,3(2H)-diyl)diacetate
Smiles: CCCCOC(=O)Cn1c2ccccc2n(c1=O)CC(=O)OCCCC
STK528758
Synonyms: 5-[(E)-{2-[(2-hydroxyphenyl)carbonyl]hydrazinylidene}methyl]-4-(isoquinolinium-2-yl)-2-oxo-1,3-thiazol-3-ide
Smiles: O=c1[n-]c(c(s1)/C=N/NC(=O)c1ccccc1O)[n+]1ccc2c(c1)cccc2
STK528759
Synonyms: 3,3'-[(4-methoxyphenyl)methanediyl]bis(2-phenyl-1H-indole)
Smiles: COc1ccc(cc1)C(c1c([nH]c2c1cccc2)c1ccccc1)c1c([nH]c2c1cccc2)c1ccccc1
STK528760
Synonyms: 2-[bis(5-methylfuran-2-yl)methyl]-4-methoxy-6-nitrophenol
Smiles: COc1cc(C(c2ccc(o2)C)c2ccc(o2)C)c(c(c1)[N+](=O)[O-])O
STK528762
Synonyms: 1-{(E)-[(2-hydroxyphenyl)imino]methyl}-3-nitro-6,7,8,9-tetrahydrodibenzo[b,d]furan-2-ol
Smiles: [O-][N+](=O)c1cc2oc3c(c2c(c1O)/C=N/c1ccccc1O)CCCC3
STK528763
Synonyms: 1-ethyl-6-fluoro-7-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CCn1cc(C(=O)Nc2nnc(s2)CC(C)C)c(=O)c2c1cc(N1CCN(CC1)C(=O)c1ccco1)c(c2)F
STK528765
Synonyms: 8-bromo-3-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Brc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc(cc1)N(C)C
STK528766
Synonyms: 4-[2-amino-3-cyano-4,4-bis(trifluoromethyl)-4,5,6,7-tetrahydro-1H-cyclopenta[b]pyridin-1-yl]-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide
Smiles: N#CC1=C(N)N(c2ccc(cc2)S(=O)(=O)Nc2nc(C)cc(n2)C)C2=C(C1(C(F)(F)F)C(F)(F)F)CCC2
STK528768
Synonyms: 8-(benzylsulfanyl)-7-heptyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCn1c(SCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C
STK528769
Synonyms: 2-[4-(4-chlorophenyl)piperazin-1-yl]-1-(1H-indol-3-yl)ethanone
Smiles: Clc1ccc(cc1)N1CCN(CC1)CC(=O)c1c[nH]c2c1cccc2
STK528770
Synonyms: N-{(1E)-1-[4-(diethylamino)phenyl]-3-[(2E)-2-(4-hydroxy-3,5-dimethoxybenzylidene)hydrazinyl]-3-oxoprop-1-en-2-yl}benzamide
Smiles: CCN(c1ccc(cc1)/C=C(\C(=O)N/N=C/c1cc(OC)c(c(c1)OC)O)/NC(=O)c1ccccc1)CC
STK528771
Synonyms: ethyl3-{[(4-benzylpiperazin-1-yl)acetyl]amino}-5-fluoro-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)Cc1ccccc1)cc(cc2)F
STK528772
Synonyms: 3-{[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]amino}-2-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1cc(ccc1O)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cccc1
STK528773
Synonyms: 4-(2-amino-3,5-dicyano-6-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}pyridin-4-yl)phenylacetate
Smiles: N#Cc1c(SCC(=O)c2ccc(cc2)C)nc(c(c1c1ccc(cc1)OC(=O)C)C#N)N
STK528776
Synonyms: 8-bromo-3-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}-2-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1cc(ccc1OC)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cc(cc1)Br
STK528778
Synonyms: ethyl2-oxo-4-(undecylamino)-1,2-dihydroquinoline-3-carboxylate
Smiles: CCCCCCCCCCCNc1c2ccccc2[nH]c(=O)c1C(=O)OCC
STK528782
Synonyms: 7-[3-(4-bromophenoxy)-2-hydroxypropyl]-3-methyl-8-(4-methylpiperazin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: OC(Cn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)C)COc1ccc(cc1)Br
STK528784
Synonyms: ethyl(2S)-2-propyl-1-oxaspiro[2.5]octane-2-carboxylate
Smiles: CCC[C@@]1(OC21CCCCC2)C(=O)OCC
STK528786
Synonyms: N-(2-chlorophenyl)-2-(2,4-dichlorophenyl)quinazolin-4-amine
Smiles: Clc1ccc(c(c1)Cl)c1nc(Nc2ccccc2Cl)c2c(n1)cccc2
STK528787
Synonyms: (6E)-6-(3-hydroxy-4-methoxybenzylidene)-1,3-dimethyl-3a,9a-diphenyl-3,3a,9,9a-tetrahydroimidazo[4,5-e][1,3]thiazolo[3,2-b][1,2,4]triazine-2,7(1H,6H)-dione
Smiles: COc1ccc(cc1O)/C=c\1/sc2=NC3(C(Nn2c1=O)(c1ccccc1)N(C(=O)N3C)C)c1ccccc1
STK528789
Synonyms: 4-(butylamino)-6-chloro-2-(methylsulfanyl)pyrimidine-5-carbonitrile
Smiles: CCCCNc1nc(SC)nc(c1C#N)Cl
STK528791
Synonyms: 1,3-dimethyl-2-[(1E)-prop-1-en-1-yl]-2,3-dihydro-1H-benzimidazole
Smiles: C/C=C/C1N(C)c2c(N1C)cccc2
STK528792
Synonyms: methyl{[6-amino-3,5-dicyano-4-(2-methylpropyl)pyridin-2-yl]sulfanyl}acetate
Smiles: COC(=O)CSc1nc(N)c(c(c1C#N)CC(C)C)C#N
STK528793
Synonyms: dimethyl{[(2,4-dimethylphenyl)amino](phenyl)methyl}phosphonate
Smiles: COP(=O)(C(c1ccccc1)Nc1ccc(cc1C)C)OC
STK528796
Synonyms: 1,7-dibenzyl-8-{(2E)-2-[1-(4-hydroxyphenyl)ethylidene]hydrazinyl}-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Oc1ccc(cc1)/C(=N/Nc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)Cc1ccccc1)/C
STK528797
Synonyms: [1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(chloromethyl)-1H-1,2,3-triazol-4-yl]methanol
Smiles: ClCc1c(CO)nnn1c1nonc1N
STK528799
Synonyms: 1,1'-benzene-1,3-diylbis[3-(4-fluorophenyl)(thiourea)]
Smiles: S=C(Nc1ccc(cc1)F)Nc1cccc(c1)NC(=S)Nc1ccc(cc1)F
STK528800
Synonyms: 2-(4-chlorophenyl)-4-[(2E)-2-(3,4-dimethoxybenzylidene)hydrazinyl]quinazoline
Smiles: COc1cc(/C=N/Nc2nc(nc3c2cccc3)c2ccc(cc2)Cl)ccc1OC
STK528801
Synonyms: N-[(4Z)-4-(4-hydroxy-3-methoxybenzylidene)-5-oxo-1-(2,4,6-trichlorophenyl)-4,5-dihydro-1H-pyrazol-3-yl]-3-nitrobenzamide
Smiles: COc1cc(ccc1O)/C=C\1/C(=NN(C1=O)c1c(Cl)cc(cc1Cl)Cl)NC(=O)c1cccc(c1)[N+](=O)[O-]
STK528802
Synonyms: 1-(1,2-dimethyl-1H-indol-3-yl)-2-[4-(diphenylmethyl)piperazin-1-yl]ethanone
Smiles: O=C(c1c2ccccc2n(c1C)C)CN1CCN(CC1)C(c1ccccc1)c1ccccc1
STK528807
Synonyms: 3-{[(E)-(2-methoxyphenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccccc1/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1
STK528809
Synonyms: 7-(3-{[4-chloro-5-methyl-2-(propan-2-yl)phenoxy]methyl}-4-methoxyphenyl)-6H,7H,8H-pyrano[3,2-c:5,6-c']dichromene-6,8-dione
Smiles: COc1ccc(cc1COc1cc(C)c(cc1C(C)C)Cl)C1c2c(=O)oc3c(c2Oc2c1c(=O)oc1c2cccc1)cccc3
STK528810
Synonyms: 4-[(1E)-1-{2-[2-(4-methoxyphenyl)quinazolin-4-yl]hydrazinylidene}ethyl]phenol
Smiles: COc1ccc(cc1)c1nc(N/N=C(/c2ccc(cc2)O)\C)c2c(n1)cccc2
STK528812
Synonyms: methyl5-methyl-3-{[3-(pyrrolidin-1-yl)propanoyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CCN1CCCC1)cc(cc2)C
STK528814
Synonyms: 3-bromo-1-{(E)-[(6-methylpyridin-2-yl)imino]methyl}-6,7,8,9-tetrahydrodibenzo[b,d]furan-2-ol
Smiles: Cc1cccc(n1)/N=C/c1c(O)c(Br)cc2c1c1CCCCc1o2
STK528815
Synonyms: [4-chloro-6-(dimethylamino)-1,3,5-triazin-2-yl](2-chloroethyl)cyanamide
Smiles: ClCCN(c1nc(Cl)nc(n1)N(C)C)C#N
STK528816
Synonyms: (5E)-1-(4-ethoxyphenyl)-5-({[2-(pyridin-3-yl)piperidin-1-yl]amino}methylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCOc1ccc(cc1)N1C(=O)NC(=O)/C(=C\NN2CCCCC2c2cccnc2)/C1=O
STK528820
Synonyms: 5-phenyl-2,4-bis(2,4,6-trimethylphenyl)-1H-imidazole
Smiles: Cc1cc(C)c(c(c1)C)c1[nH]c(c(n1)c1c(C)cc(cc1C)C)c1ccccc1
STK528821
Synonyms: 2-[4-(4-fluorophenyl)piperazin-1-yl]-1-(5-methoxy-1H-indol-3-yl)ethanone
Smiles: COc1ccc2c(c1)c(c[nH]2)C(=O)CN1CCN(CC1)c1ccc(cc1)F
STK528822
Synonyms: 4-(3-ethylpyridinium-1-yl)-2-oxo-5-{(E)-[2-(phenylcarbonyl)hydrazinylidene]methyl}-1,3-thiazol-3-ide
Smiles: CCc1ccc[n+](c1)c1[n-]c(=O)sc1/C=N/NC(=O)c1ccccc1
STK528824
Synonyms: N-{2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}pyridine-3-carboxamide
Smiles: CCOc1ccc2c(c1)sc(n2)NC(C(F)(F)F)(C(F)(F)F)NC(=O)c1cccnc1
STK528827
Synonyms: N~6~-benzyl-N~4~-cyclohexyl-7-nitro-2,1,3-benzoxadiazole-4,6-diamine
Smiles: [O-][N+](=O)c1c(NCc2ccccc2)cc(c2c1non2)NC1CCCCC1
STK528828
Synonyms: 3-methyl-7-(3-phenylpropyl)-8-(piperazin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=c1[nH]c(=O)n(c2c1n(CCCc1ccccc1)c(n2)N1CCNCC1)C
STK528831
Synonyms: 3-methyl-7-nonyl-8-(nonylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCSc1nc2c(n1CCCCCCCCC)c(=O)[nH]c(=O)n2C
STK528832
Synonyms: 4-methyl-1,2,3-thiadiazole-5-carbohydrazide
Smiles: NNC(=O)c1snnc1C
STK528833
Synonyms: 2-chloro-N-[2-(3-fluorophenyl)-1,3-benzoxazol-5-yl]-5-iodobenzamide
Smiles: Fc1cccc(c1)c1nc2c(o1)ccc(c2)NC(=O)c1cc(I)ccc1Cl
STK528834
Synonyms: 8-bromo-3-{[(E)-(3-bromo-2-hydroxyphenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Brc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cccc(c1O)Br
STK528835
Synonyms: 1-ethyl-6-fluoro-7-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-N-(4-methylpyridin-2-yl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CCn1cc(C(=O)Nc2nccc(c2)C)c(=O)c2c1cc(N1CCN(CC1)C(=O)c1ccco1)c(c2)F
STK528837
Synonyms: furan-2-yl(4-{2-[2-(naphthalen-1-yloxy)ethoxy]ethyl}piperazin-1-yl)methanone
Smiles: O=C(c1ccco1)N1CCN(CC1)CCOCCOc1cccc2c1cccc2
STK528839
Synonyms: (2E)-2-[4-(heptyloxy)benzylidene]-N-(4-methoxybenzyl)hydrazinecarbothioamide
Smiles: CCCCCCCOc1ccc(cc1)/C=N/NC(=S)NCc1ccc(cc1)OC
STK528840
Synonyms: N-(2-chlorobenzyl)-1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CCn1cc(C(=O)NCc2ccccc2Cl)c(=O)c2c1cc(N1CCN(CC1)C)c(c2)F
STK528841
Synonyms: 8-{(2E)-2-[1-(4-methoxyphenyl)ethylidene]hydrazinyl}-3-methyl-7-octyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCn1c(N/N=C(/c2ccc(cc2)OC)\C)nc2c1c(=O)[nH]c(=O)n2C
STK528842
Synonyms: 5,5'-diphenyl-3,3'-bi-1,2,4-oxadiazole
Smiles: c1ccc(cc1)c1onc(n1)c1noc(n1)c1ccccc1
STK528843
Synonyms: (2E)-1-(2,4-dinitrophenyl)-2-[2-methyl-5-(propan-2-ylidene)cyclopentylidene]hydrazine
Smiles: CC1CCC(=C(C)C)/C/1=N/Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
STK528845
Synonyms: 8-bromo-3-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Brc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc(cc1)C(C)C
STK528847
Synonyms: methyl3-[({4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}acetyl)amino]-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1cccc(c1)C(F)(F)F)cccc2
STK528849
Synonyms: 2-(3,4-dichlorophenyl)-4-[(2E)-2-(3-methoxybenzylidene)hydrazinyl]quinazoline
Smiles: COc1cccc(c1)/C=N/Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl
STK528851
Synonyms: 3-({(E)-[4-(dimethylamino)-2,3,5,6-tetrafluorophenyl]methylidene}amino)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Fc1c(/C=N/n2cnc3c(c2=O)[nH]c2c3cccc2)c(F)c(c(c1F)N(C)C)F
STK528852
Synonyms: 8-bromo-7-[2-hydroxy-3-(4-iodophenoxy)propyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Ic1ccc(cc1)OCC(Cn1c(Br)nc2c1c(=O)n(C)c(=O)n2C)O
STK528854
Synonyms: 1-ethyl-6-fluoro-7-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-N-nonyl-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CCCCCCCCCNC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C(=O)c1ccco1)F
STK528856
Synonyms: 1,3-dimethyl-4-(4-methylphenyl)-3a,6a-diphenyltetrahydroimidazo[4,5-d]imidazole-2,5(1H,3H)-dione
Smiles: Cc1ccc(cc1)N1C(=O)NC2(C1(c1ccccc1)N(C)C(=O)N2C)c1ccccc1
STK528858
Synonyms: (5Z)-1-methyl-5-[4-(octyloxy)benzylidene]-3-phenylpyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCCCCCCCOc1ccc(cc1)/C=C\1/C(=O)N(C)C(=O)N(C1=O)c1ccccc1
STK528860
Synonyms: ethyl(2E)-2-(1-phenylethylidene)hydrazinecarboxylate
Smiles: CCOC(=O)N/N=C(/c1ccccc1)\C
STK528862
Synonyms: 7-heptyl-8-[(2-hydroxyethyl)sulfanyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCn1c(SCCO)nc2c1c(=O)[nH]c(=O)n2C
STK528863
Synonyms: 3-[2-(4-fluorophenyl)ethyl]-8-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)CCc1ccc(cc1)F
STK528864
Synonyms: 8-(heptylsulfanyl)-7-hexadecyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCCCCCn1c(SCCCCCCC)nc2c1c(=O)[nH]c(=O)n2C
STK528865
Synonyms: 4-({(2E)-3-(4-bromophenyl)-2-[(phenylcarbonyl)amino]prop-2-enoyl}amino)butanoicacid
Smiles: OC(=O)CCCNC(=O)/C(=C\c1ccc(cc1)Br)/NC(=O)c1ccccc1
STK528866
Synonyms: 3-methyl-7-octyl-8-(octylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCSc1nc2c(n1CCCCCCCC)c(=O)[nH]c(=O)n2C
STK528867
Synonyms: 7-[3-(4-ethylphenoxy)-2-hydroxypropyl]-8-(hexylsulfanyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCSc1nc2c(n1CC(COc1ccc(cc1)CC)O)c(=O)[nH]c(=O)n2C
STK528868
Synonyms: 7-[(3-hydroxypropyl)amino]-1-methyl-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione
Smiles: OCCCNc1cc2oc3cccc(c3[nH]c2c2c1c(=O)c1c(c2=O)cccc1)C
STK528869
Synonyms: 8-bromo-3-methyl-7-octyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCn1c(Br)nc2c1c(=O)[nH]c(=O)n2C
STK528870
Synonyms: 2-[4-(2-fluorophenyl)piperazin-1-yl]-1-(1H-indol-3-yl)ethanone
Smiles: Fc1ccccc1N1CCN(CC1)CC(=O)c1c[nH]c2c1cccc2
STK528872
Synonyms: 3-{[(E)-(3-iodophenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Ic1cccc(c1)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1
STK528876
Synonyms: 7-heptyl-3-methyl-8-[(2E)-2-(3-nitrobenzylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCn1c(N/N=C/c2cccc(c2)[N+](=O)[O-])nc2c1c(=O)[nH]c(=O)n2C
STK528877
Synonyms: 4-{(2E)-2-[1-(3,4-dimethoxyphenyl)ethylidene]hydrazinyl}[1,2,4]triazolo[4,3-a]quinoxaline
Smiles: COc1cc(ccc1OC)/C(=N/Nc1nc2ccccc2n2c1nnc2)/C
STK528879
Synonyms: 2-methyl-2-[(Z)-[(5-nitrofuran-2-yl)methylidene](oxido)-lambda~5~-azanyl]cyclohexanone
Smiles: O=C1CCCCC1(C)/[N+](=C/c1ccc(o1)[N+](=O)[O-])/[O-]
STK528880
Synonyms: 1-(1H-indol-3-yl)-2-(2-methylpiperidin-1-yl)ethanone
Smiles: CC1CCCCN1CC(=O)c1c[nH]c2c1cccc2
STK528881
Synonyms: hexyl4-[(4,5-dimethoxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)amino]benzoate
Smiles: CCCCCCOC(=O)c1ccc(cc1)NC1OC(=O)c2c1ccc(c2OC)OC
STK528882
Synonyms: 3-(2,2-dichloroethenyl)-N'-[(E)-{3-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-4-methoxyphenyl}methylidene]-2,2-dimethylcyclopropanecarbohydrazide
Smiles: COc1ccc(cc1CN1C(=O)c2c(C1=O)cccc2)/C=N/NC(=O)C1C(C1(C)C)C=C(Cl)Cl
STK528884
Synonyms: 2-(2-chlorophenyl)-N-(2,5-dimethylphenyl)quinazolin-4-amine
Smiles: Cc1ccc(c(c1)Nc1nc(nc2c1cccc2)c1ccccc1Cl)C
STK528885
Synonyms: ethyl3-[(E)-(4-benzylpiperidin-1-yl)diazenyl]-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1/N=N/N1CCC(CC1)Cc1ccccc1)cccc2
STK528886
Synonyms: benzyl3-(benzylsulfanyl)-3-(1H-indol-3-yl)-2-nitropropanoate
Smiles: [O-][N+](=O)C(C(c1c[nH]c2c1cccc2)SCc1ccccc1)C(=O)OCc1ccccc1
STK528887
Synonyms: 8-methoxy-3-{[(E)-(2-methoxyphenyl)methylidene]amino}-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: COc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1ccccc1OC
STK528888
Synonyms: ethyl3-({[4-(4-chlorophenyl)piperazin-1-yl]acetyl}amino)-5-methoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)Cl)cc(cc2)OC
STK528891
Synonyms: 6-fluoro-1-(2-fluoroethyl)-7-(4-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylicacid
Smiles: FCCn1cc(C(=O)O)c(=O)c2c1cc(N1CCN(CC1)C)c(c2)F
STK528892
Synonyms: 3-{[(E)-(5-bromo-2-hydroxyphenyl)methylidene]amino}-8-methyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: Brc1ccc(c(c1)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(cc1)C)O
STK528894
Synonyms: 4-(3-ethylpyridinium-1-yl)-5-formyl-2-oxo-1,3-thiazol-3-ide
Smiles: CCc1ccc[n+](c1)c1[n-]c(=O)sc1C=O
STK528895
Synonyms: 2-(5,6-diphenyl-1,2,4-triazin-3-yl)-N-(naphthalen-1-yl)hydrazinecarboxamide
Smiles: O=C(Nc1cccc2c1cccc2)NNc1nnc(c(n1)c1ccccc1)c1ccccc1
STK528896
Synonyms: 6-(2,6-dimethoxyphenoxy)-N-(furan-2-ylmethyl)hexan-1-amine
Smiles: COc1cccc(c1OCCCCCCNCc1ccco1)OC
STK528897
Synonyms: 4-[2-amino-3-cyano-4,4-bis(trifluoromethyl)-4,5,6,7-tetrahydro-1H-cyclopenta[b]pyridin-1-yl]-N-(6-methoxypyridazin-3-yl)benzenesulfonamide
Smiles: N#CC1=C(N)N(c2ccc(cc2)S(=O)(=O)Nc2ccc(nn2)OC)C2=C(C1(C(F)(F)F)C(F)(F)F)CCC2
STK528898
Synonyms: 3-{[(E)-(4-methylphenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Cc1ccc(cc1)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1
STK528899
Synonyms: 2-(diphenylmethyl)-N-[(4-methylphenyl)sulfonyl]hydrazinecarboxamide
Smiles: O=C(NS(=O)(=O)c1ccc(cc1)C)NNC(c1ccccc1)c1ccccc1
STK528902
Synonyms: methyl5-bromo-3-[(3,4-dihydroisoquinolin-2(1H)-ylacetyl)amino]-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCc3c(C1)cccc3)cc(cc2)Br
STK528903
Synonyms: 5-cyano-6-(hexylsulfanyl)-2-methyl-N-phenyl-1,4-dihydro-4,4'-bipyridine-3-carboxamide
Smiles: CCCCCCSC1=C(C#N)C(C(=C(N1)C)C(=O)Nc1ccccc1)c1ccncc1
STK528904
Synonyms: methyl5-bromo-3-[(thiomorpholin-4-ylacetyl)amino]-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCSCC1)cc(cc2)Br
STK528905
Synonyms: 2-(4-bromophenyl)-1-[3-(piperidin-1-yl)propyl]-1H-imidazo[1,2-a]benzimidazole
Smiles: Brc1ccc(cc1)c1cn2c(n1CCCN1CCCCC1)nc1c2cccc1
STK528906
Synonyms: 3-methyl-7-(3-methylbut-2-en-1-yl)-8-(4-methylpiperazin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CN1CCN(CC1)c1nc2c(n1CC=C(C)C)c(=O)[nH]c(=O)n2C
STK528908
Synonyms: 2-{[(E)-1H-benzimidazol-2-ylmethylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Smiles: N#Cc1c(/N=C/c2nc3c([nH]2)cccc3)sc2c1CCCC2
STK528910
Synonyms: (2,2,2-trichloroethane-1,1-diyl)bis-2-methylbenzene-4,1-diyldiacetate
Smiles: CC(=O)Oc1ccc(cc1C)C(C(Cl)(Cl)Cl)c1ccc(c(c1)C)OC(=O)C
STK528911
Synonyms: 4-ethyl-N-[(1Z)-4,4,7-trimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-ylidene]aniline
Smiles: CCc1ccc(cc1)/N=c/1\ssc2c1c1ccc(cc1NC2(C)C)C
STK528915
Synonyms: 6-nitro-1-[(E)-(pyridin-2-ylimino)methyl]naphthalen-2-ol
Smiles: Oc1ccc2c(c1/C=N/c1ccccn1)ccc(c2)[N+](=O)[O-]
STK528916
Synonyms: 3-{[(E)-(4-chlorophenyl)methylidene]amino}-2-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Clc1ccc(cc1)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cccc1
STK528917
Synonyms: 2-amino-1-(2,4-difluorophenyl)-4,4-bis(trifluoromethyl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(C2=C(C1(C(F)(F)F)C(F)(F)F)CCCC2)c1ccc(cc1F)F
STK528918
Synonyms: 2-{[(3,4-dichlorophenyl)carbamoyl]amino}-N-(4-methylphenyl)benzamide
Smiles: Cc1ccc(cc1)NC(=O)c1ccccc1NC(=O)Nc1ccc(c(c1)Cl)Cl
STK528919
Synonyms: 2-amino-4-(4-butoxyphenyl)-6-{[2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl]sulfanyl}pyridine-3,5-dicarbonitrile
Smiles: CCCCOc1ccc(cc1)c1c(C#N)c(SCC(=O)c2cc3ccccc3oc2=O)nc(c1C#N)N
STK528921
Synonyms: 3-(4-tert-butylphenoxy)-5-oxo-5H-anthra[1,9-cd][1,2]oxazol-6-ylbenzoate
Smiles: O=C1C=C(Oc2ccc(cc2)C(C)(C)C)c2c3c1c(OC(=O)c1ccccc1)c1ccccc1c3on2
STK528922
Synonyms: 2-(2-chlorophenyl)-4-{(2E)-2-[1-(4-methoxyphenyl)ethylidene]hydrazinyl}quinazoline
Smiles: COc1ccc(cc1)/C(=N/Nc1nc(nc2c1cccc2)c1ccccc1Cl)/C
STK528924
Synonyms: methyl3-{[(1-heptyl-4-hydroxy-2-oxo-1,2-dihydroquinolin-3-yl)carbonyl]amino}thiophene-2-carboxylate
Smiles: CCCCCCCn1c(=O)c(C(=O)Nc2ccsc2C(=O)OC)c(c2c1cccc2)O
STK528925
Synonyms: 7-hexadecyl-3-methyl-8-(piperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCCCC1
STK528926
Synonyms: ethyl4-(8-methoxy-5H-pyrimido[5,4-b]indol-4-yl)piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)c1ncnc2c1[nH]c1c2cc(cc1)OC
STK528928
Synonyms: (2Z)-3-[(4-chloro-2,5-dimethoxyphenyl)amino]-2-[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C/Nc1cc(OC)c(cc1OC)Cl)/c1scc(n1)c1ccc(cc1Cl)Cl
STK528930
Synonyms: 2,2,3,3,4,4,4-heptafluoro-N-{2-[(heptafluoropropyl)sulfanyl]phenyl}butanamide
Smiles: O=C(C(C(C(F)(F)F)(F)F)(F)F)Nc1ccccc1SC(C(C(F)(F)F)(F)F)(F)F
STK528932
Synonyms: methyl5-bromo-3-{[N-(2,2-dimethoxyethyl)-N-methylglycyl]amino}-1H-indole-2-carboxylate
Smiles: COC(CN(CC(=O)Nc1c([nH]c2c1cc(Br)cc2)C(=O)OC)C)OC
STK528933
Synonyms: 3-{[(E)-(4-methoxyphenyl)methylidene]amino}-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: COc1ccc(cc1)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cccc1
STK528934
Synonyms: methyl3-phenylimidazo[1,2-a]pyridine-2-carboxylate
Smiles: COC(=O)c1nc2n(c1c1ccccc1)cccc2
STK528935
Synonyms: diphenyl{[4-(dimethylamino)phenyl][(3-nitrophenyl)amino]methyl}phosphonate
Smiles: CN(c1ccc(cc1)C(P(=O)(Oc1ccccc1)Oc1ccccc1)Nc1cccc(c1)[N+](=O)[O-])C
STK528937
Synonyms: N-decyl-N'-(4-phenyl-1,3-thiazol-2-yl)ethanediamide
Smiles: CCCCCCCCCCNC(=O)C(=O)Nc1scc(n1)c1ccccc1
STK528939
Synonyms: 3-[(4-chloro-2,5-dimethoxyphenyl)amino]-6,7-dimethoxy-2-benzofuran-1(3H)-one
Smiles: COc1cc(Cl)c(cc1NC1OC(=O)c2c1ccc(c2OC)OC)OC
STK528941
Synonyms: (2E)-2-{4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl}-3-{[3-(trifluoromethyl)phenyl]amino}prop-2-enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)C(F)(F)F)/c1scc(n1)c1ccc(cc1)CC(C)C
STK528942
Synonyms: N-(6-methylpyridin-2-yl)-2-oxo-2H-pyran-5-carboxamide
Smiles: Cc1cccc(n1)NC(=O)c1ccc(=O)oc1
STK528943
Synonyms: 7-(3-bromobenzyl)-1,3-dimethyl-8-[(2E)-2-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Brc1cccc(c1)Cn1c(N/N=C\2/C(=O)Nc3c2cccc3)nc2c1c(=O)n(c(=O)n2C)C
STK528947
Synonyms: 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-[(1R)-1-phenylethyl]-1,4-dihydroquinoline-3-carboxamide
Smiles: CCn1cc(C(=O)N[C@@H](c2ccccc2)C)c(=O)c2c1cc(N1CCN(CC1)C)c(c2)F
STK528953
Synonyms: 2-(2-chlorophenyl)-4-{(2E)-2-[1-(3,4-dimethoxyphenyl)ethylidene]hydrazinyl}quinazoline
Smiles: COc1cc(ccc1OC)/C(=N/Nc1nc(nc2c1cccc2)c1ccccc1Cl)/C
STK528955
Synonyms: N-(4-chlorophenyl)-2-(2,4-dichlorophenyl)quinazolin-4-amine
Smiles: Clc1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl
STK528956
Synonyms: 2-tert-butyl-1-[2-(4-methylpiperazin-1-yl)ethyl]-1H-imidazo[1,2-a]benzimidazole
Smiles: CN1CCN(CC1)CCn1c2nc3c(n2cc1C(C)(C)C)cccc3
STK528957
Synonyms: 2-[2-(4-bromophenyl)-1H-imidazo[1,2-a]benzimidazol-1-yl]-N,N-diethylethanamine
Smiles: CCN(CCn1c(cn2c1nc1c2cccc1)c1ccc(cc1)Br)CC
STK528958
Synonyms: ethyl1-ethyl-6-nitro-4-oxo-1,4-dihydroquinoline-3-carboxylate
Smiles: CCOC(=O)c1cn(CC)c2c(c1=O)cc(cc2)[N+](=O)[O-]
STK528959
Synonyms: 4-(octylsulfinyl)tetrahydrothiophene-3-ol1,1-dioxide
Smiles: CCCCCCCCS(=O)C1CS(=O)(=O)CC1O
STK528961
Synonyms: 3-(2,6-dimethoxyphenoxy)-2-methyl-N-(tetrahydrofuran-2-ylmethyl)propan-1-amine
Smiles: COc1cccc(c1OCC(CNCC1CCCO1)C)OC
STK528962
Synonyms: (2,2,2',2',4,4'-hexamethyl-1,2,3,4-tetrahydro-4,6'-biquinolin-1'(2'H)-yl)(4-nitrophenyl)methanone
Smiles: CC1=CC(C)(C)N(c2c1cc(cc2)C1(C)CC(C)(C)Nc2c1cccc2)C(=O)c1ccc(cc1)[N+](=O)[O-]
STK528963
Synonyms: 1-[bis(2-hydroxyethyl)amino]-3-(diphenylamino)propan-2-ol
Smiles: OCCN(CC(CN(c1ccccc1)c1ccccc1)O)CCO
STK528965
Synonyms: (7E)-7-(2-bromobenzylidene)-3,4-diphenyl-4H-[1,3]thiazolo[2,3-c][1,2,4]triazin-6(7H)-one
Smiles: Brc1ccccc1/C=c\1/sc2=NN=C(C(n2c1=O)c1ccccc1)c1ccccc1
STK528966
Synonyms: (2Z)-3-[4-(6-chloro-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-2-(3,4-dichlorophenyl)prop-2-enenitrile
Smiles: N#C/C(=C\c1scc(n1)c1cc2cc(Cl)ccc2oc1=O)/c1ccc(c(c1)Cl)Cl
STK528967
Synonyms: diphenyl{[(4-bromophenyl)amino](4-methoxyphenyl)methyl}phosphonate
Smiles: COc1ccc(cc1)C(P(=O)(Oc1ccccc1)Oc1ccccc1)Nc1ccc(cc1)Br
STK528968
Synonyms: 4-(4-chlorophenoxy)-2-(3,4-dichlorophenyl)quinazoline
Smiles: Clc1ccc(cc1)Oc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl
STK528969
Synonyms: 5-[(E)-{2-[(2-hydroxyphenyl)carbonyl]hydrazinylidene}methyl]-2-oxo-4-[4-(phenylcarbonyl)pyridinium-1-yl]-1,3-thiazol-3-ide
Smiles: O=c1sc(c([n-]1)[n+]1ccc(cc1)C(=O)c1ccccc1)/C=N/NC(=O)c1ccccc1O
STK528971
Synonyms: 2-[(3-methyl-7-octyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetamide
Smiles: CCCCCCCCn1c(SCC(=O)N)nc2c1c(=O)[nH]c(=O)n2C
STK528972
Synonyms: 1-[6-(4-fluorophenoxy)hexyl]-4-(2-methoxyphenyl)piperazine
Smiles: COc1ccccc1N1CCN(CC1)CCCCCCOc1ccc(cc1)F
STK528974
Synonyms: methyl4-{[2-(4-chlorophenyl)quinazolin-4-yl]oxy}benzoate
Smiles: COC(=O)c1ccc(cc1)Oc1nc(nc2c1cccc2)c1ccc(cc1)Cl
STK528975
Synonyms: 3-{[(E)-(2,4-dihydroxyphenyl)methylidene]amino}-2-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Oc1ccc(c(c1)O)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cccc1
STK528976
Synonyms: 6-(diethylamino)-2-methyl-3-(propan-2-yl)hex-4-yn-3-ol
Smiles: CCN(CC#CC(C(C)C)(C(C)C)O)CC
STK528977
Synonyms: diphenyl{(4-methoxyphenyl)[(4-nitrophenyl)amino]methyl}phosphonate
Smiles: COc1ccc(cc1)C(P(=O)(Oc1ccccc1)Oc1ccccc1)Nc1ccc(cc1)[N+](=O)[O-]
STK528980
Synonyms: 1-(3,6-dibromo-9H-carbazol-9-yl)-3-(naphthalen-1-ylamino)propan-2-ol
Smiles: OC(Cn1c2ccc(cc2c2c1ccc(c2)Br)Br)CNc1cccc2c1cccc2
STK528981
Synonyms: 2-oxo-5-{(E)-[2-(phenylcarbonyl)hydrazinylidene]methyl}-4-[4-(phenylcarbonyl)pyridinium-1-yl]-1,3-thiazol-3-ide
Smiles: O=c1sc(c([n-]1)[n+]1ccc(cc1)C(=O)c1ccccc1)/C=N/NC(=O)c1ccccc1
STK528983
Synonyms: 8-methyl-3-{[(E)-(4-nitrophenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Cc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc(cc1)[N+](=O)[O-]
STK528984
Synonyms: 1-(1-phenylcyclopentyl)-N-(4-propoxybenzyl)methanamine
Smiles: CCCOc1ccc(cc1)CNCC1(CCCC1)c1ccccc1
STK528985
Synonyms: methyl5-chloro-3-({[4-(ethoxycarbonyl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc(Cl)cc2)C(=O)OC
STK528986
Synonyms: 3-{[(E)-(4-fluorophenyl)methylidene]amino}-8-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc(cc1)F
STK528988
Synonyms: ethylN-{[4-(pentyloxy)phenyl]carbonyl}glycylglycinate
Smiles: CCCCCOc1ccc(cc1)C(=O)NCC(=O)NCC(=O)OCC
STK528989
Synonyms: ethylN-[(2-chlorophenyl)carbonyl]-2-[(2-chloropyridin-3-yl)amino]-3,3,3-trifluoroalaninate
Smiles: CCOC(=O)C(C(F)(F)F)(NC(=O)c1ccccc1Cl)Nc1cccnc1Cl
STK528990
Synonyms: 5,5'-piperazine-1,4-diylbis[4-nitro-7-(piperidin-1-yl)-2,1,3-benzoxadiazole]
Smiles: [O-][N+](=O)c1c(cc(c2c1non2)N1CCCCC1)N1CCN(CC1)c1cc(N2CCCCC2)c2c(c1[N+](=O)[O-])non2
STK528991
Synonyms: 3-(1-methyl-5-oxo-2-thioxoimidazolidin-4-yl)propanamide
Smiles: CN1C(=O)C(NC1=S)CCC(=O)N
STK528992
Synonyms: (5E)-3-(1,1-dioxidotetrahydrothiophen-3-yl)-2-thioxo-5-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)-1,3-thiazolidin-4-one
Smiles: S=C1S/C(=C/c2ccc(o2)c2cccc(c2)C(F)(F)F)/C(=O)N1C1CCS(=O)(=O)C1
STK528993
Synonyms: 1,7-dibenzyl-3-methyl-8-[(2E)-2-(3-nitrobenzylidene)hydrazinyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: [O-][N+](=O)c1cccc(c1)/C=N/Nc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)Cc1ccccc1
STK528994
Synonyms: methyl3-({[4-(2-hydroxyethyl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: OCCN1CCN(CC1)CC(=O)Nc1c([nH]c2c1cccc2)C(=O)OC
STK528995
Synonyms: 3-({(E)-[4-(prop-2-en-1-yloxy)phenyl]methylidene}amino)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: C=CCOc1ccc(cc1)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1
STK528996
Synonyms: ethyl5-fluoro-3-{[(4-methylpiperazin-1-yl)acetyl]amino}-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C)cc(cc2)F
STK528997
Synonyms: 4-chloro-2-(methylsulfanyl)-6-(propan-2-ylamino)pyrimidine-5-carbonitrile
Smiles: CSc1nc(NC(C)C)c(c(n1)Cl)C#N
STK528998
Synonyms: methyl3-({[(3S)-4-(3-methoxyphenyl)-3-methylpiperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: COc1cccc(c1)N1CCN(CC1C)CC(=O)Nc1c([nH]c2c1cccc2)C(=O)OC
STK529002
Synonyms: ethyl5-fluoro-3-{[(2-methylpiperidin-1-yl)acetyl]amino}-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCCCC1C)cc(cc2)F
STK529005
Synonyms: 3-{[(E)-(4-chlorophenyl)methylidene]amino}-8-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: COc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1ccc(cc1)Cl
STK529006
Synonyms: 4,4'-(phenylmethanediyl)bis(1-hexyl-3-methyl-1H-pyrazol-5-ol)
Smiles: CCCCCCn1nc(c(c1O)C(c1c(C)nn(c1O)CCCCCC)c1ccccc1)C
STK529007
Synonyms: ({7-[2-hydroxy-3-(2-methylphenoxy)propyl]-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}sulfanyl)aceticacid
Smiles: OC(Cn1c(SCC(=O)O)nc2c1c(=O)[nH]c(=O)n2C)COc1ccccc1C
STK529008
Synonyms: 8-bromo-3-methyl-7-nonyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCn1c(Br)nc2c1c(=O)[nH]c(=O)n2C
STK529009
Synonyms: 5-{[(1S,2S)-2-chlorocyclopentyl]sulfanyl}-2-phenyl-2H-tetrazole
Smiles: Cl[C@H]1CCC[C@@H]1Sc1nnn(n1)c1ccccc1
STK529010
Synonyms: 4-(4-benzylpiperazin-1-yl)-1-(5-methyl-2,3-diphenyl-1H-indol-1-yl)butan-2-ol
Smiles: Cc1ccc2c(c1)c(c1ccccc1)c(n2CC(CCN1CCN(CC1)Cc1ccccc1)O)c1ccccc1
STK529011
Synonyms: N-(2-chlorobenzyl)-N'-[4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,3-thiazol-2-yl]ethanediamide
Smiles: O=C(C(=O)Nc1scc(n1)C12CC3CC(C2)CC(C1)C3)NCc1ccccc1Cl
STK529012
Synonyms: 2-[(E)-({2-[(2-methylphenyl)amino]-1-benzofuran-3-yl}imino)methyl]phenol
Smiles: Cc1ccccc1Nc1oc2c(c1/N=C/c1ccccc1O)cccc2
STK529013
Synonyms: ethyl3-[(3,4-dihydroisoquinolin-2(1H)-ylacetyl)amino]-5-fluoro-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCc3c(C1)cccc3)cc(cc2)F
STK529015
Synonyms: 2-amino-N-(4-chlorophenyl)-3,5-dinitrobenzamide
Smiles: Clc1ccc(cc1)NC(=O)c1cc(cc(c1N)[N+](=O)[O-])[N+](=O)[O-]
STK529017
Synonyms: methyl5-bromo-3-{[(3-methylpiperidin-1-yl)acetyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCCC(C1)C)cc(cc2)Br
STK529018
Synonyms: methyl5-methyl-3-[(thiomorpholin-4-ylacetyl)amino]-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCSCC1)cc(cc2)C
STK529019
Synonyms: N-(4-bromophenyl)-2-(3,4-dichlorophenyl)quinazolin-4-amine
Smiles: Brc1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl
STK529020
Synonyms: 4-[2-(2,6-dimethoxyphenoxy)ethyl]thiomorpholine
Smiles: COc1cccc(c1OCCN1CCSCC1)OC
STK529021
Synonyms: 6-bromo-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)quinoline-4-carboxylicacid
Smiles: Brc1ccc2c(c1)c(cc(n2)C12CC3CC(C2)CC(C1)C3)C(=O)O
STK529024
Synonyms: bis[3-amino-4-(dimethylamino)phenyl]methanone
Smiles: O=C(c1ccc(c(c1)N)N(C)C)c1ccc(c(c1)N)N(C)C
STK529025
Synonyms: 5-(4-hydroxyphenyl)-3,4,5,6-tetrahydrobenzo[a]phenanthridin-1(2H)-one
Smiles: Oc1ccc(cc1)C1Nc2ccc3c(c2C2=C1CCCC2=O)cccc3
STK529027
Synonyms: N-[(3Z)-2-methyl-3-(phenylamino)-3-(phenylimino)propyl]-N-phenyltridecanamide
Smiles: CCCCCCCCCCCCC(=O)N(c1ccccc1)CC(/C(=N/c1ccccc1)/Nc1ccccc1)C
STK529028
Synonyms: 2-(2-chlorophenyl)-4-[(2E)-2-(2,4-dichlorobenzylidene)hydrazinyl]quinazoline
Smiles: Clc1ccc(c(c1)Cl)/C=N/Nc1nc(nc2c1cccc2)c1ccccc1Cl
STK529029
Synonyms: ethyl3,3,3-trifluoro-N-({2-[(4-methylphenyl)sulfonyl]hydrazinyl}carbonyl)-2-phenoxyalaninate
Smiles: CCOC(=O)C(C(F)(F)F)(Oc1ccccc1)NC(=O)NNS(=O)(=O)c1ccc(cc1)C
STK529030
Synonyms: 2-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)-N-{1-[(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)acetyl]-1,2,3,4-tetrahydroquinolin-4-yl}-N-phenylacetamide
Smiles: O=C(N1CCC(c2c1cccc2)N(C(=O)Cn1c(=O)c2cccc3c2c(c1=O)ccc3)c1ccccc1)Cn1c(=O)c2cccc3c2c(c1=O)ccc3
STK529031
Synonyms: N'-[(E)-(1,3-diphenyl-1H-pyrazol-4-yl)methylidene]-N-(4-oxo-3-phenyl-3,4-dihydroquinazolin-2-yl)acetohydrazide
Smiles: CC(=O)N(c1nc2ccccc2c(=O)n1c1ccccc1)/N=C/c1cn(nc1c1ccccc1)c1ccccc1
STK529033
Synonyms: 3-decyl-1-methyl-9-phenyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Smiles: CCCCCCCCCCn1c(=O)c2n3CCCN(c3nc2n(c1=O)C)c1ccccc1
STK529034
Synonyms: N-{2-[(3-cyano-4-ethyl-5-methylthiophen-2-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}benzamide
Smiles: N#Cc1c(sc(c1CC)C)NC(C(F)(F)F)(C(F)(F)F)NC(=O)c1ccccc1
STK529035
Synonyms: 10-(3-hydroxyphenyl)-3,3,6,6-tetramethyl-3,4,6,7,9,10-hexahydroacridine-1,8(2H,5H)-dione
Smiles: Oc1cccc(c1)N1C2=C(CC3=C1CC(C)(C)CC3=O)C(=O)CC(C2)(C)C
STK529038
Synonyms: 4-(2,4-dimethylphenyl)-2-[(2-methylpropanoyl)amino]thiophene-3-carboxylicacid
Smiles: O=C(C(C)C)Nc1scc(c1C(=O)O)c1ccc(cc1C)C
STK529039
Synonyms: 3-({(E)-[4-(decyloxy)phenyl]methylidene}amino)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: CCCCCCCCCCOc1ccc(cc1)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1
STK529040
Synonyms: 4-(azepan-1-yl)-2-(2-chlorophenyl)quinazoline
Smiles: Clc1ccccc1c1nc(N2CCCCCC2)c2c(n1)cccc2
STK529041
Synonyms: ethyl6,7-difluoro-1-hexyl-4-oxo-1,4-dihydroquinoline-3-carboxylate
Smiles: CCCCCCn1cc(C(=O)OCC)c(=O)c2c1cc(F)c(c2)F
STK529042
Synonyms: ethyl[(2E)-2-(3,4-dimethoxybenzylidene)hydrazinyl](oxo)acetate
Smiles: CCOC(=O)C(=O)N/N=C/c1ccc(c(c1)OC)OC
STK529044
Synonyms: 2-(2-chlorophenyl)-N-(2,5-dimethoxyphenyl)quinazolin-4-amine
Smiles: COc1ccc(c(c1)Nc1nc(nc2c1cccc2)c1ccccc1Cl)OC
STK529045
Synonyms: N'-[(1E)-1-(6-chloro-2-oxo-2H-chromen-3-yl)ethylidene]pyridine-4-carbohydrazide
Smiles: Clc1ccc2c(c1)cc(c(=O)o2)/C(=N/NC(=O)c1ccncc1)/C
STK529046
Synonyms: 1,1'-{4-methyl-6-[methyl(nitroso)amino]benzene-1,3-diyl}diethanone
Smiles: O=NN(c1cc(C)c(cc1C(=O)C)C(=O)C)C
STK529049
Synonyms: N,N-dimethyl-4-[(3-methyl-9H-carbazol-9-yl)methyl]aniline
Smiles: Cc1ccc2c(c1)c1ccccc1n2Cc1ccc(cc1)N(C)C
STK529050
Synonyms: (1E)-N,N-dimethyl-N'-[(4-methylphenyl)sulfonyl]ethanimidamide
Smiles: Cc1ccc(cc1)S(=O)(=O)/N=C(/N(C)C)\C
STK529051
Synonyms: 2-butyl4-methyl3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate
Smiles: CCCCOC(=O)c1[nH]c(c(c1C)C(=O)OC)C
STK529052
Synonyms: 4-hydrazinyl-2-phenyl-6H-spiro[benzo[h]quinazoline-5,1'-cyclopentane]
Smiles: NNc1nc(nc2c1C1(CCCC1)Cc1c2cccc1)c1ccccc1
STK529054
Synonyms: (2E)-3-[(2-iodophenyl)amino]-2-[4-(6-nitro-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccccc1I)/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]
STK529055
Synonyms: 2-(4-benzylpiperidin-1-yl)-1-(5-methoxy-1H-indol-3-yl)ethanol
Smiles: COc1ccc2c(c1)c(c[nH]2)C(CN1CCC(CC1)Cc1ccccc1)O
STK529056
Synonyms: 3-(4-chloro-3-fluorophenyl)-1-(5-methyl-4,5-dihydro-1,3-thiazol-2-yl)-1-(4-methylphenyl)urea
Smiles: CC1CN=C(S1)N(c1ccc(cc1)C)C(=O)Nc1ccc(c(c1)F)Cl
STK529059
Synonyms: ethyl5-methoxy-3-[(E)-thiomorpholin-4-yldiazenyl]-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1/N=N/N1CCSCC1)cc(cc2)OC
STK529060
Synonyms: methyl5-methyl-3-({[4-(3-methyl-2,6-dioxo-7-propyl-2,3,6,7-tetrahydro-1H-purin-8-yl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: CCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc(C)cc2)C(=O)OC
STK529062
Synonyms: 8-methoxy-3-({(E)-[4-(octyloxy)phenyl]methylidene}amino)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: CCCCCCCCOc1ccc(cc1)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)OC
STK529063
Synonyms: ethyl3-{(E)-[4-(diphenylmethyl)piperazin-1-yl]diazenyl}-5-methoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1/N=N/N1CCN(CC1)C(c1ccccc1)c1ccccc1)cc(cc2)OC
STK529066
Synonyms: 4-{(2E)-2-[1-(4-bromophenyl)ethylidene]hydrazinyl}-2-(3,4-dichlorophenyl)quinazoline
Smiles: Brc1ccc(cc1)/C(=N/Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl)/C
STK529067
Synonyms: 2-[(2E)-2-(2-fluorobenzylidene)hydrazinyl]-3-methylquinoxaline
Smiles: Cc1nc2ccccc2nc1N/N=C/c1ccccc1F
STK529068
Synonyms: ethylN-[(3-cyano-4-ethyl-5-methylthiophen-2-yl)carbamoyl]-3,3,3-trifluoro-2-(2,2,2-trifluoroethoxy)alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(NC(=O)Nc1sc(c(c1C#N)CC)C)OCC(F)(F)F
STK529069
Synonyms: 8-methyl-3-{[(E)-(3-nitrophenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Cc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cccc(c1)[N+](=O)[O-]
STK529070
Synonyms: ethyl2-{[(E)-(2-hydroxynaphthalen-1-yl)methylidene]amino}-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate
Smiles: CCOC(=O)c1c(/N=C/c2c(O)ccc3c2cccc3)sc2c1CCN(C2)C
STK529071
Synonyms: 7-{[2-(3,4-dichlorophenyl)-2-oxoethyl]sulfanyl}-9-oxo-8-azaspiro[4.5]dec-6-ene-6,10-dicarbonitrile
Smiles: N#CC1C(=O)NC(=C(C21CCCC2)C#N)SCC(=O)c1ccc(c(c1)Cl)Cl
STK529073
Synonyms: ethyl3-amino-1-(2-chlorophenyl)-1H-benzo[f]chromene-2-carboxylate
Smiles: CCOC(=O)C1=C(N)Oc2c(C1c1ccccc1Cl)c1ccccc1cc2
STK529074
Synonyms: ethyl4-({N-[(4-butoxyphenyl)carbonyl]-beta-alanyl}amino)butanoate
Smiles: CCCCOc1ccc(cc1)C(=O)NCCC(=O)NCCCC(=O)OCC
STK529075
Synonyms: 7-hexadecyl-8-(hexylsulfanyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCCCCCn1c(SCCCCCC)nc2c1c(=O)[nH]c(=O)n2C
STK529076
Synonyms: 2,2,2-trichloro-1-{[4-(phenoxymethyl)-6-({2,2,2-trichloro-1-[(phenylcarbamoyl)oxy]ethyl}amino)-1,3,5-triazin-2-yl]amino}ethyl(4-chlorophenyl)carbamate
Smiles: O=C(OC(C(Cl)(Cl)Cl)Nc1nc(nc(n1)COc1ccccc1)NC(C(Cl)(Cl)Cl)OC(=O)Nc1ccccc1)Nc1ccc(cc1)Cl
STK529077
Synonyms: methyl2,4-dimethyl-5-[(E)-(naphthalen-1-ylimino)methyl]-1H-pyrrole-3-carboxylate
Smiles: COC(=O)c1c(C)[nH]c(c1C)/C=N/c1cccc2c1cccc2
STK529078
Synonyms: 2-ethyl-6-[(4-fluorophenyl)carbonyl]-5,11-dihydro-4H-thieno[3',2':5,6]pyrimido[1,2-b]isoquinolin-4-one
Smiles: CCc1cc2c(s1)n1Cc3ccccc3C(=c1[nH]c2=O)C(=O)c1ccc(cc1)F
STK529079
Synonyms: ethyl3-({[3-(ethoxycarbonyl)piperidin-1-yl]acetyl}amino)-5-methoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)C1CCCN(C1)CC(=O)Nc1c([nH]c2c1cc(OC)cc2)C(=O)OCC
STK529080
Synonyms: 7-decyl-8-[(2-hydroxypropyl)sulfanyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCn1c(SCC(O)C)nc2c1c(=O)[nH]c(=O)n2C
STK529082
Synonyms: 7-benzyl-8-(dodecylsulfanyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCSc1nc2c(n1Cc1ccccc1)c(=O)[nH]c(=O)n2C
STK529083
Synonyms: N-(2,4-dimethyl-5-nitrophenyl)-4-ethoxy-3-(1-methyl-7-oxo-3-propyl-6,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-5-yl)benzenesulfonamide
Smiles: CCCc1nn(c2c1nc([nH]c2=O)c1cc(ccc1OCC)S(=O)(=O)Nc1cc([N+](=O)[O-])c(cc1C)C)C
STK529085
Synonyms: 1,7-dibenzyl-8-[(2E)-2-(4-bromobenzylidene)hydrazinyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Brc1ccc(cc1)/C=N/Nc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)Cc1ccccc1
STK529086
Synonyms: 3,6-diphenyl-9-[4-(propan-2-yloxy)phenyl]-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Smiles: CC(Oc1ccc(cc1)C1C2=C(OC3=C1C(=O)CC(C3)c1ccccc1)CC(CC2=O)c1ccccc1)C
STK529088
Synonyms: (3aS,6aS)-3-(diphenylacetyl)-5-[2-(trifluoromethyl)phenyl]-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione
Smiles: O=C(C1=NN[C@H]2[C@@H]1C(=O)N(C2=O)c1ccccc1C(F)(F)F)C(c1ccccc1)c1ccccc1
STK529090
Synonyms: methyl5-chloro-3-{[(2-methylpiperidin-1-yl)acetyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCCCC1C)cc(cc2)Cl
STK529092
Synonyms: 8-bromo-3-{[(E)-pyridin-3-ylmethylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Brc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cccnc1
STK529093
Synonyms: N,N-diethyl-4-{[(triethylstannanyl)oxy]carbonyl}benzenesulfonamide
Smiles: CCN(S(=O)(=O)c1ccc(cc1)C(=O)O[Sn](CC)(CC)CC)CC
STK529094
Synonyms: 2-(2-chlorophenyl)-4-[(2E)-2-(2-nitrobenzylidene)hydrazinyl]quinazoline
Smiles: Clc1ccccc1c1nc(N/N=C/c2ccccc2[N+](=O)[O-])c2c(n1)cccc2
STK529096
Synonyms: 1,5-bis(4-methylphenyl)-3,7-diphenyl-1,5,3,7-diazadiphosphocane
Smiles: Cc1ccc(cc1)N1CP(CN(CP(C1)c1ccccc1)c1ccc(cc1)C)c1ccccc1
STK529097
Synonyms: (2E)-2-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-3-[(3-nitrophenyl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)[N+](=O)[O-])/c1scc(n1)c1ccc(cc1C)C
STK529099
Synonyms: (2Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-(3-ethoxy-4-hydroxyphenyl)prop-2-enenitrile
Smiles: CCOc1cc(ccc1O)/C=C(\c1scc(n1)c1ccc2c(c1)OCO2)/C#N
STK529102
Synonyms: 3-(3-bromopropyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: BrCCCn1cnc2c(c1=O)[nH]c1c2cccc1
STK529103
Synonyms: ethyl3-amino-1-(4-hydroxy-3-methoxyphenyl)-1H-benzo[f]chromene-2-carboxylate
Smiles: CCOC(=O)C1=C(N)Oc2c(C1c1ccc(c(c1)OC)O)c1ccccc1cc2
STK529105
Synonyms: N-(4-bromophenyl)-2-(2,4-dichlorophenyl)quinazolin-4-amine
Smiles: Brc1ccc(cc1)Nc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl
STK529106
Synonyms: (7,7-dimethyl-2-{2-[(2-phenylquinolin-4-yl)carbonyl]hydrazinylidene}bicyclo[2.2.1]hept-1-yl)methanesulfonicacid
Smiles: O=C(c1cc(nc2c1cccc2)c1ccccc1)N/N=C/1\CC2C(C1(CC2)CS(=O)(=O)O)(C)C
STK529108
Synonyms: 7-{4-[(3-chlorophenyl)carbonyl]piperazin-1-yl}-1-cyclopropyl-6-fluoro-4-oxo-N-(pyridin-4-ylmethyl)-1,4-dihydroquinoline-3-carboxamide
Smiles: Clc1cccc(c1)C(=O)N1CCN(CC1)c1cc2n(cc(c(=O)c2cc1F)C(=O)NCc1ccncc1)C1CC1
STK529109
Synonyms: 4-[(7-chloro-4-nitro-2,1,3-benzoxadiazol-5-yl)amino]benzoicacid
Smiles: [O-][N+](=O)c1c(Nc2ccc(cc2)C(=O)O)cc(c2c1non2)Cl
STK529110
Synonyms: 1-(9-methyl-9H-carbazol-3-yl)propan-1-one
Smiles: CCC(=O)c1ccc2c(c1)c1ccccc1n2C
STK529112
Synonyms: methyl5-chloro-3-({[4-(4-chlorophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccc(cc1)Cl)cc(cc2)Cl
STK529113
Synonyms: 4-(biphenyl-4-yloxy)-2-(2-chlorophenyl)quinazoline
Smiles: Clc1ccccc1c1nc(Oc2ccc(cc2)c2ccccc2)c2c(n1)cccc2
STK529114
Synonyms: (2E)-3-phenyl-1-[2,2,4-trimethyl-4-(4-methylphenyl)-6-trityl-3,4-dihydroquinolin-1(2H)-yl]prop-2-en-1-one
Smiles: Cc1ccc(cc1)C1(C)CC(C)(C)N(c2c1cc(cc2)C(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)/C=C/c1ccccc1
STK529116
Synonyms: 2,3-diphenyl-5,6,7,8-tetrahydroquinoxaline1,4-dioxide
Smiles: [O-][n+]1c(c2ccccc2)c(c2ccccc2)[n+](c2c1CCCC2)[O-]
STK529117
Synonyms: 2-methyl-3-[(2E)-2-(3-nitrobenzylidene)hydrazinyl]quinoxaline
Smiles: Cc1nc2ccccc2nc1N/N=C/c1cccc(c1)[N+](=O)[O-]
STK529119
Synonyms: 6-bromo-N'-[(4E)-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-ylidene]-2-(thiophen-2-yl)quinoline-4-carbohydrazide
Smiles: Brc1ccc2c(c1)c(cc(n2)c1cccs1)C(=O)N/N=C/1\CCCc2c1non2
STK529121
Synonyms: 1-ethyl-6-fluoro-7-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-N-hexyl-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CCCCCCNC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C(=O)c1ccco1)F
STK529122
Synonyms: (2Z)-N-(4-methoxybenzyl)-2-(1-phenylethylidene)hydrazinecarbothioamide
Smiles: COc1ccc(cc1)CNC(=S)N/N=C(\c1ccccc1)/C
STK529123
Synonyms: 4-[(3-amino-3-oxopropanoyl)amino]benzoicacid
Smiles: NC(=O)CC(=O)Nc1ccc(cc1)C(=O)O
STK529124
Synonyms: 3-({(E)-[2-hydroxy-3-(prop-2-en-1-yl)phenyl]methylidene}amino)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: C=CCc1cccc(c1O)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1
STK529126
Synonyms: 8-chloro-3-[2-(cyclohex-1-en-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Clc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)CCC1=CCCCC1
STK529127
Synonyms: 8-bromo-3-(3,5-dimethoxybenzyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1cc(cc(c1)OC)Cn1cnc2c(c1=O)[nH]c1c2cc(cc1)Br
STK529129
Synonyms: N-(2,2-dimethylpropanoyl)glycylmethionine
Smiles: CSCCC(C(=O)O)NC(=O)CNC(=O)C(C)(C)C
STK529130
Synonyms: 2-phenyl-1-[3-(pyrrolidin-1-yl)propyl]-1H-imidazo[1,2-a]benzimidazole
Smiles: c1ccc(cc1)c1cn2c(n1CCCN1CCCC1)nc1c2cccc1
STK529131
Synonyms: 3-imino-1-methyl-5,7-diphenyl-2,6-dioxabicyclo[2.2.2]octane-4,8,8-tricarbonitrile
Smiles: N#CC12C(=N)OC(OC1c1ccccc1)(C(C2(C#N)C#N)c1ccccc1)C
STK529132
Synonyms: 5-cyano-N-(2-methoxyphenyl)-2-methyl-6-(prop-2-en-1-ylsulfanyl)-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
Smiles: C=CCSC1=C(C#N)C(C(=C(N1)C)C(=O)Nc1ccccc1OC)c1cccs1
STK529133
Synonyms: 3-{[(E)-(4-hydroxyphenyl)methylidene]amino}-8-methyl-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: Oc1ccc(cc1)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(cc1)C
STK529134
Synonyms: methyl3-({3-[4-(2,3-dimethylphenyl)piperazin-1-yl]propanoyl}amino)-5-methyl-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1cccc(c1C)C)cc(cc2)C
STK529137
Synonyms: 4-(4-benzylpiperidin-1-yl)-8-methyl-5H-pyrimido[5,4-b]indole
Smiles: Cc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCC(CC1)Cc1ccccc1
STK529138
Synonyms: 4-[(2E)-2-benzylidenehydrazinyl]-2-(4-chlorophenyl)quinazoline
Smiles: Clc1ccc(cc1)c1nc(N/N=C/c2ccccc2)c2c(n1)cccc2
STK529140
Synonyms: 8-bromo-3-({(E)-[4-(dimethylamino)-2,3,5,6-tetrafluorophenyl]methylidene}amino)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Brc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1c(F)c(F)c(c(c1F)F)N(C)C
STK529143
Synonyms: morpholin-4-yl{3-[(E)-2-(morpholin-4-yl)ethenyl]-2-nitrophenyl}methanone
Smiles: O=C(c1cccc(c1[N+](=O)[O-])/C=C/N1CCOCC1)N1CCOCC1
STK529144
Synonyms: 3-[(2-ethoxyphenyl)amino]-6,7-dimethoxy-2-benzofuran-1(3H)-one
Smiles: CCOc1ccccc1NC1OC(=O)c2c1ccc(c2OC)OC
STK529145
Synonyms: 3-{[(E)-(3-chlorophenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Clc1cccc(c1)/C=N/n1cnc2c(c1=O)[nH]c1c2cccc1
STK529146
Synonyms: 3,3'-[(4-ethoxyphenyl)methanediyl]bis(2-phenyl-1H-indole)
Smiles: CCOc1ccc(cc1)C(c1c([nH]c2c1cccc2)c1ccccc1)c1c([nH]c2c1cccc2)c1ccccc1
STK529147
Synonyms: 7-[2-hydroxy-3-(4-methoxyphenoxy)propyl]-8-[(2E)-2-(4-methoxybenzylidene)hydrazinyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: COc1ccc(cc1)OCC(Cn1c(N/N=C/c2ccc(cc2)OC)nc2c1c(=O)[nH]c(=O)n2C)O
STK529149
Synonyms: (2E)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-{[3-(trifluoromethyl)phenyl]amino}prop-2-enenitrile
Smiles: N#C/C(=C\Nc1cccc(c1)C(F)(F)F)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]
STK529153
Synonyms: 2,2-dimethyl-5-nitro-2H-benzimidazol-4-amine3-oxide
Smiles: CC1(C)N=c2c(=[N+]1[O-])c(N)c(cc2)[N+](=O)[O-]
STK529154
Synonyms: N-(3-bromo-4-methylphenyl)-4-nitro-7-(piperidin-1-yl)-2,1,3-benzoxadiazol-5-amine
Smiles: [O-][N+](=O)c1c(Nc2ccc(c(c2)Br)C)cc(c2c1non2)N1CCCCC1
STK529155
Synonyms: 2-{[5-acetyl-3-cyano-6-methyl-4-(2-methylpropyl)-1,4-dihydropyridin-2-yl]sulfanyl}acetamide
Smiles: N#CC1=C(SCC(=O)N)NC(=C(C1CC(C)C)C(=O)C)C
STK529158
Synonyms: 1-ethyl-N-(2-hexyl-4-oxoquinazolin-3(4H)-yl)-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxamide
Smiles: CCCCCCc1nc2ccccc2c(=O)n1NC(=O)c1c(O)c2ccccc2n(c1=O)CC
STK529159
Synonyms: N-heptyl-N'-[4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,3-thiazol-2-yl]ethanediamide
Smiles: CCCCCCCNC(=O)C(=O)Nc1scc(n1)C12CC3CC(C2)CC(C1)C3
STK529161
Synonyms: (2Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-(2-methylphenyl)prop-2-enenitrile
Smiles: N#C/C(=C/c1ccccc1C)/c1scc(n1)c1ccc2c(c1)OCO2
STK529162
Synonyms: N-[(1E)-1-(3,4-dimethoxyphenyl)-3-{(2E)-2-[1-(3,4-dimethoxyphenyl)ethylidene]hydrazinyl}-3-oxoprop-1-en-2-yl]benzamide
Smiles: COc1ccc(cc1OC)/C=C(\C(=O)N/N=C(/c1ccc(c(c1)OC)OC)\C)/NC(=O)c1ccccc1
STK529164
Synonyms: methyl5-chloro-3-{[N-(2,2-dimethoxyethyl)-N-methylglycyl]amino}-1H-indole-2-carboxylate
Smiles: COC(CN(CC(=O)Nc1c([nH]c2c1cc(Cl)cc2)C(=O)OC)C)OC
STK529165
Synonyms: 7-hexadecyl-3-methyl-8-(propylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCCCCCn1c(SCCC)nc2c1c(=O)[nH]c(=O)n2C
STK529166
Synonyms: 2-{2-[(2E)-2-(4-nitrobenzylidene)hydrazinyl]-1,3-thiazol-4-yl}-3H-benzo[f]chromen-3-one
Smiles: O=c1oc2ccc3c(c2cc1c1csc(n1)N/N=C/c1ccc(cc1)[N+](=O)[O-])cccc3
STK529167
Synonyms: ethyl2-oxo-4-(pentylamino)-1,2-dihydroquinoline-3-carboxylate
Smiles: CCCCCNc1c2ccccc2[nH]c(=O)c1C(=O)OCC
STK529168
Synonyms: methyl3-{[(2-ethylpiperidin-1-yl)acetyl]amino}-5-methyl-1H-indole-2-carboxylate
Smiles: CCC1CCCCN1CC(=O)Nc1c([nH]c2c1cc(C)cc2)C(=O)OC
STK529169
Synonyms: 6-chloro-3-(3-chloropropanoyl)-1,3-benzoxazol-2(3H)-one
Smiles: ClCCC(=O)n1c(=O)oc2c1ccc(c2)Cl
STK529171
Synonyms: 4-(4-chlorophenoxy)-2-(2,4-dichlorophenyl)quinazoline
Smiles: Clc1ccc(cc1)Oc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl
STK529172
Synonyms: (3E)-3-[(5-bromofuran-2-yl)methylidene]-5-(2-methylpropyl)furan-2(3H)-one
Smiles: CC(CC1=C/C(=C\c2ccc(o2)Br)/C(=O)O1)C
STK529174
Synonyms: 8-methoxy-3-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: COc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1ccc(cc1)C(C)C
STK529175
Synonyms: 7-(2-fluorophenyl)-6H,7H,8H-pyrano[3,2-c:5,6-c']dichromene-6,8-dione
Smiles: Fc1ccccc1C1c2c(=O)oc3c(c2Oc2c1c(=O)oc1c2cccc1)cccc3
STK529176
Synonyms: 1-(2-methoxyphenyl)-4-[6-(naphthalen-1-yloxy)hexyl]piperazine
Smiles: COc1ccccc1N1CCN(CC1)CCCCCCOc1cccc2c1cccc2
STK529177
Synonyms: 6-(4-ethylphenyl)-2,3-diphenylimidazo[1,2-b][1,2,4]triazine
Smiles: CCc1ccc(cc1)c1nc2n(c1)nc(c(n2)c1ccccc1)c1ccccc1
STK529179
Synonyms: methyl3-({[4-(ethoxycarbonyl)piperazin-1-yl]acetyl}amino)-5-methyl-1H-indole-2-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc(C)cc2)C(=O)OC
STK529181
Synonyms: N-{2-[(3-chloro-2-methylphenyl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}-4-methylbenzamide
Smiles: Cc1ccc(cc1)C(=O)NC(C(F)(F)F)(C(F)(F)F)Nc1cccc(c1C)Cl
STK529182
Synonyms: N,2-bis(3,4-dichlorophenyl)quinazolin-4-amine
Smiles: Clc1ccc(cc1Cl)Nc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl
STK529183
Synonyms: 3-(pyridin-4-ylmethyl)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: O=c1n(cnc2c1[nH]c1c2cccc1)Cc1ccncc1
STK529184
Synonyms: 3-(morpholin-4-yl)-2-phenyl-1-(4-propoxyphenyl)propan-1-one
Smiles: CCCOc1ccc(cc1)C(=O)C(c1ccccc1)CN1CCOCC1
STK529185
Synonyms: 8-(heptylsulfanyl)-3-methyl-7-octyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCSc1nc2c(n1CCCCCCCC)c(=O)[nH]c(=O)n2C
STK529186
Synonyms: 2-[(7-hexadecyl-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]-N-phenylacetamide
Smiles: CCCCCCCCCCCCCCCCn1c(SCC(=O)Nc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C
STK529188
Synonyms: 3-{[(E)-(4-methoxyphenyl)methylidene]amino}-2-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc(cc1)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cccc1
STK529189
Synonyms: (3Z)-2-(diphenylacetyl)-3-{(2E)-[(2E)-3-phenylprop-2-en-1-ylidene]hydrazinylidene}-2,3-dihydro-1H-inden-1-one
Smiles: O=C1c2ccccc2/C(=N\N=C\C=C\c2ccccc2)/C1C(=O)C(c1ccccc1)c1ccccc1
STK529190
Synonyms: 2-(2-chlorophenyl)-N-(3-chlorophenyl)quinazolin-4-amine
Smiles: Clc1cccc(c1)Nc1nc(nc2c1cccc2)c1ccccc1Cl
STK529191
Synonyms: 3-{[(E)-(2-hydroxy-3-methoxyphenyl)methylidene]amino}-8-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: COc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1cccc(c1O)OC
STK529193
Synonyms: N-(4-methoxyphenyl)-2-[(2-methylpropanoyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1c(NC(=O)C(C)C)sc2c1CCC2
STK529194
Synonyms: ethyl3,3,3-trifluoro-N-(furan-2-ylcarbonyl)-2-[(2-methoxyphenyl)amino]alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(Nc1ccccc1OC)NC(=O)c1ccco1
STK529195
Synonyms: N-[4-(1,3-dioxo-2,3-dihydro-1H-inden-2-yl)phenyl]pentanamide
Smiles: CCCCC(=O)Nc1ccc(cc1)C1C(=O)c2c(C1=O)cccc2
STK529197
Synonyms: (2E)-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-3-[(2-methyl-4-nitrophenyl)amino]prop-2-enenitrile
Smiles: COc1ccc(cc1)c1csc(n1)/C(=C/Nc1ccc(cc1C)[N+](=O)[O-])/C#N
STK529199
Synonyms: 2-[(E)-{2-[2-(2-chlorophenyl)quinazolin-4-yl]hydrazinylidene}methyl]-6-methoxyphenol
Smiles: COc1cccc(c1O)/C=N/Nc1nc(nc2c1cccc2)c1ccccc1Cl
STK529201
Synonyms: 3,3'-[benzene-1,4-diylbis(oxy)]bis[1-(piperidin-1-yl)propan-2-ol]
Smiles: OC(CN1CCCCC1)COc1ccc(cc1)OCC(CN1CCCCC1)O
STK529202
Synonyms: (5E)-3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-5-(2-hydroxybenzylidene)-2-thioxo-1,3-thiazolidin-4-one
Smiles: Oc1ccccc1/C=C\1/SC(=S)N(C1=O)c1c(C)n(n(c1=O)c1ccccc1)C
STK529203
Synonyms: 3-chloro-N-[(1Z)-8-methoxy-4,4-dimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-ylidene]-2-methylaniline
Smiles: COc1ccc2c(c1)c1/c(=N/c3cccc(c3C)Cl)/ssc1C(N2)(C)C
STK529205
Synonyms: methyl5-chloro-3-({[4-(3-methoxyphenyl)-3-methylpiperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: COc1cccc(c1)N1CCN(CC1C)CC(=O)Nc1c([nH]c2c1cc(Cl)cc2)C(=O)OC
STK529206
Synonyms: 5-(anthracen-9-ylmethyl)-1,3-dimethyl-5-{[(1R,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]methyl}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: S=C1N(C)C(=O)C(C(=O)N1C)(CN1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)Cc1c2ccccc2cc2c1cccc2
STK529207
Synonyms: 1,1'-(2,3,8-trimethyl-5,6-dihydrodipyrrolo[1,2-a:2',1'-c]pyrazine-1,10-diyl)bis(trifluoroethanone)
Smiles: Cc1cc(c2n1CCn1c2c(c(c1C)C)C(=O)C(F)(F)F)C(=O)C(F)(F)F
STK529208
Synonyms: (2Z)-3-phenyl-2-{4-[4-(phenylsulfanyl)phenyl]-1,3-thiazol-2-yl}prop-2-enenitrile
Smiles: N#C/C(=C/c1ccccc1)/c1scc(n1)c1ccc(cc1)Sc1ccccc1
STK529209
Synonyms: 4-(4-benzylpiperidin-1-yl)-2-(4-bromophenyl)quinazoline
Smiles: Brc1ccc(cc1)c1nc(N2CCC(CC2)Cc2ccccc2)c2c(n1)cccc2
STK529210
Synonyms: 2-(butylsulfanyl)-5-(4,5-dimethoxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)-6-hydroxy-3-phenylpyrimidin-4(3H)-one
Smiles: CCCCSc1nc(O)c(c(=O)n1c1ccccc1)C1OC(=O)c2c1ccc(c2OC)OC
STK529211
Synonyms: 2-ethyl-N-[(1Z)-4,4,6-trimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-ylidene]aniline
Smiles: CCc1ccccc1/N=c/1\ssc2c1c1cccc(c1NC2(C)C)C
STK529212
Synonyms: 2-{[(E)-furan-2-ylmethylidene]amino}-6-methyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carbonitrile
Smiles: N#Cc1c(/N=C/c2ccco2)sc2c1CCN(C2)C
STK529214
Synonyms: methyl5-methyl-3-[(3-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}propanoyl)amino]-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1cccc(c1)C(F)(F)F)cc(cc2)C
STK529218
Synonyms: 1,3,4,5-tetraphenyl-1,4-dihydro-1,2,4-diazaphosphinine4-sulfide
Smiles: S=P1(c2ccccc2)C(=CN(N=C1c1ccccc1)c1ccccc1)c1ccccc1
STK529220
Synonyms: 2-benzyl-4-(methylsulfanyl)-6H-spiro[benzo[h]quinazoline-5,1'-cyclohexane]
Smiles: CSc1nc(Cc2ccccc2)nc2c1C1(CCCCC1)Cc1c2cccc1
STK529221
Synonyms: 8-(benzylsulfanyl)-3-methyl-7-nonyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCn1c(SCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C
STK529222
Synonyms: methyl4,6-bis(dimethylamino)-1,3,5-triazine-2-carboxylate
Smiles: COC(=O)c1nc(nc(n1)N(C)C)N(C)C
STK529223
Synonyms: 2,2'-(1,3,4-thiadiazole-2,5-diyldisulfanediyl)bis(N'-{(E)-[4-(dimethylamino)phenyl]methylidene}acetohydrazide)
Smiles: CN(c1ccc(cc1)/C=N/NC(=O)CSc1nnc(s1)SCC(=O)N/N=C/c1ccc(cc1)N(C)C)C
STK529225
Synonyms: 2-(8-methyl-3-oxo-8-phenylhexahydro-7H-[1,3]thiazolo[3,2-a]pyrazin-7-yl)acetohydrazide
Smiles: NNC(=O)CN1CCN2C(C1(C)c1ccccc1)SCC2=O
STK529226
Synonyms: ethyl[(E)-(4-bromophenyl)diazenyl][(ethylsulfanyl)(phenyl)phosphoryl]acetate
Smiles: CCOC(=O)C(P(=O)(c1ccccc1)SCC)/N=N/c1ccc(cc1)Br
STK529229
Synonyms: methyl5-methyl-3-[(E)-(4-phenylpiperazin-1-yl)diazenyl]-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1/N=N/N1CCN(CC1)c1ccccc1)cc(cc2)C
STK529230
Synonyms: methyl{3-[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-2,5-dioxoimidazolidin-1-yl}acetate
Smiles: COC(=O)CN1C(=O)CN(C1=O)c1nc(nc(n1)N(C)C)N(C)C
STK529231
Synonyms: (5E)-5-{[5-(4-bromophenyl)furan-2-yl]methylidene}-3-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-thioxo-1,3-thiazolidin-4-one
Smiles: Brc1ccc(cc1)c1ccc(o1)/C=C\1/SC(=S)N(C1=O)c1c(C)n(n(c1=O)c1ccccc1)C
STK529233
Synonyms: 8-methoxy-3-{[(E)-(4-nitrophenyl)methylidene]amino}-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: COc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/c1ccc(cc1)[N+](=O)[O-]
STK529234
Synonyms: 4-(2-methylpropoxy)-N-{(1E)-3-[(4-nitrophenyl)amino]-3-oxo-1-phenylprop-1-en-2-yl}benzamide
Smiles: CC(COc1ccc(cc1)C(=O)N/C(=C/c1ccccc1)/C(=O)Nc1ccc(cc1)[N+](=O)[O-])C
STK529236
Synonyms: dipropan-2-yl(1-bromo-2-oxoethyl)phosphonate
Smiles: O=CC(P(=O)(OC(C)C)OC(C)C)Br
STK529237
Synonyms: 4-[4-(diphenylmethyl)piperazin-1-yl]-8-methyl-5H-pyrimido[5,4-b]indole
Smiles: Cc1ccc2c(c1)c1ncnc(c1[nH]2)N1CCN(CC1)C(c1ccccc1)c1ccccc1
STK529238
Synonyms: 2-(3,3-dimethylpiperidin-1-yl)-1-(1H-indol-3-yl)ethanol
Smiles: OC(c1c[nH]c2c1cccc2)CN1CCCC(C1)(C)C
STK529239
Synonyms: diethyl2,2'-(8-bromo-3-methyl-2,6-dioxo-3,6-dihydro-1H-purine-1,7(2H)-diyl)diacetate
Smiles: CCOC(=O)Cn1c(Br)nc2c1c(=O)n(CC(=O)OCC)c(=O)n2C
STK529240
Synonyms: 3,3'-[benzene-1,4-diylbis(oxy)]bis[1-(diethylamino)propan-2-ol]
Smiles: CCN(CC(COc1ccc(cc1)OCC(CN(CC)CC)O)O)CC
STK529241
Synonyms: 3-methyl-1-phenyl-6-(piperidin-1-yl)-4,4-bis(trifluoromethyl)-1,4-dihydropyrazolo[4,3-e][1,3]oxazine
Smiles: Cc1nn(c2c1C(N=C(O2)N1CCCCC1)(C(F)(F)F)C(F)(F)F)c1ccccc1
STK529242
Synonyms: methyl3-{[(4-benzylpiperazin-1-yl)acetyl]amino}-5-methoxy-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)Cc1ccccc1)cc(cc2)OC
STK529243
Synonyms: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(1H-indol-3-yl)ethanone
Smiles: O=C(c1c[nH]c2c1cccc2)CN1CCN(CC1)Cc1ccc2c(c1)OCO2
STK529245
Synonyms: 2-(2,4-dichlorophenyl)-4-[(2E)-2-(2-methoxybenzylidene)hydrazinyl]quinazoline
Smiles: COc1ccccc1/C=N/Nc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl
STK529248
Synonyms: N'-[(3E)-5-bromo-2-oxo-1-{[2-(pyridin-3-yl)piperidin-1-yl]methyl}-1,2-dihydro-3H-indol-3-ylidene]-3,4-dimethoxybenzohydrazide
Smiles: COc1cc(ccc1OC)C(=O)N/N=C/1\c2cc(Br)ccc2N(C1=O)CN1CCCCC1c1cccnc1
STK529249
Synonyms: 1-[2-(2,6-dimethoxyphenoxy)ethyl]-4-(diphenylmethyl)piperazine
Smiles: COc1cccc(c1OCCN1CCN(CC1)C(c1ccccc1)c1ccccc1)OC
STK529250
Synonyms: 6-bromo-2-[(2E)-2-(furan-2-ylmethylidene)hydrazinyl]-4-phenylquinoline
Smiles: Brc1ccc2c(c1)c(cc(n2)N/N=C/c1ccco1)c1ccccc1
STK529251
Synonyms: (2,4,5,6-tetrabromobenzene-1,3-diyl)dimethanol
Smiles: OCc1c(Br)c(CO)c(c(c1Br)Br)Br
STK529253
Synonyms: 1-(3,4-dichlorophenyl)-2-(3-hexadecyl-2-imino-2,3-dihydro-1H-benzimidazol-1-yl)ethanone
Smiles: CCCCCCCCCCCCCCCCn1c(=N)n(c2c1cccc2)CC(=O)c1ccc(c(c1)Cl)Cl
STK529254
Synonyms: 2-tert-butyl-9-(prop-2-en-1-yl)-9H-imidazo[1,2-a]benzimidazole
Smiles: C=CCn1c2nc(cn2c2c1cccc2)C(C)(C)C
STK529255
Synonyms: ethyl5-methoxy-3-[(E)-(4-phenylpiperazin-1-yl)diazenyl]-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1/N=N/N1CCN(CC1)c1ccccc1)cc(cc2)OC
STK529257
Synonyms: 2-(2,4-dichlorophenyl)-4-(propan-2-yloxy)quinazoline
Smiles: CC(Oc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl)C
STK529258
Synonyms: 8-bromo-3-({(E)-[4-(3,5-diphenyl-4,5-dihydro-1H-pyrazol-1-yl)phenyl]methylidene}amino)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Brc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc(cc1)N1N=C(CC1c1ccccc1)c1ccccc1
STK529260
Synonyms: 4-[(2,4-dimethylphenyl)amino]-4-oxo-3-(tetrahydrofuran-2-yl)butanoicacid
Smiles: OC(=O)CC(C(=O)Nc1ccc(cc1C)C)C1CCCO1
STK529261
Synonyms: hexadecyl(2E)-3-[5-(4-bromophenyl)furan-2-yl]-2-cyanoprop-2-enoate
Smiles: CCCCCCCCCCCCCCCCOC(=O)/C(=C/c1ccc(o1)c1ccc(cc1)Br)/C#N
STK529263
Synonyms: [1-{bis[2-(hydroxy-kappaO)ethyl]amino-kappaN}-3-butoxypropan-2-olato(3-)-kappaO]boron
Smiles: CCCCOCC1O[B-]23[N+](C1)(CCO3)CCO2
STK529264
Synonyms: 9,11-diphenyl-8,11-dihydronaphtho[1',2':4,5]imidazo[2,1-c][1,2,4]triazine
Smiles: c1ccc(cc1)N1N=C(Cn2c1nc1c2ccc2c1cccc2)c1ccccc1
STK529266
Synonyms: 1-(3-fluoro-4-methoxyphenyl)-2-phenyl-3-(pyrrolidin-1-yl)propan-1-one
Smiles: COc1ccc(cc1F)C(=O)C(c1ccccc1)CN1CCCC1
STK529268
Synonyms: N'-benzyl-2-(diethylamino)-N'-phenylacetohydrazide(non-preferredname)
Smiles: CCN(CC(=O)NN(c1ccccc1)Cc1ccccc1)CC
STK529270
Synonyms: 2-(2,4-dichlorophenyl)-4-(2-methylphenoxy)quinazoline
Smiles: Clc1ccc(c(c1)Cl)c1nc(Oc2ccccc2C)c2c(n1)cccc2
STK529272
Synonyms: (2E)-2-[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]-3-[(2-methyl-4-nitrophenyl)amino]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1C)[N+](=O)[O-])/c1scc(n1)c1ccc(c(c1)C)C
STK529273
Synonyms: 7-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-8H-naphtho[2,3-a]phenoxazine-8,13(14H)-dione
Smiles: O=c1c2ccccc2c(=O)c2c1c1[nH]c3ccccc3oc1cc2NCCC1=CCCCC1
STK529275
Synonyms: N-benzyl-2-(4-chlorophenyl)quinazolin-4-amine
Smiles: Clc1ccc(cc1)c1nc(NCc2ccccc2)c2c(n1)cccc2
STK529276
Synonyms: 8-(benzylsulfanyl)-3-methyl-7-octyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCn1c(SCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C
STK529277
Synonyms: 1-(1H-indol-3-yl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]ethanone
Smiles: COc1ccccc1N1CCN(CC1)CC(=O)c1c[nH]c2c1cccc2
STK529278
Synonyms: ethyl5-methoxy-3-{[3-(morpholin-4-yl)propanoyl]amino}-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCOCC1)cc(cc2)OC
STK529280
Synonyms: (2Z)-2-(3-bromo-2-hydroxybenzylidene)-6,7-dimethyl[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Smiles: Cc1cc2nc3n(c2cc1C)c(=O)/c(=C/c1cccc(c1O)Br)/s3
STK529281
Synonyms: 8-methoxy-3-({(E)-[4-methoxy-3-(piperidin-1-ylmethyl)phenyl]methylidene}amino)-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc(cc1CN1CCCCC1)/C=N/n1cnc2c(c1=O)[nH]c1c2cc(cc1)OC
STK529282
Synonyms: N-(1,3-benzodioxol-5-ylmethyl)-4-hydroxy-1-methyl-2-oxo-1,2-dihydroquinoline-3-carboxamide
Smiles: O=C(c1c(O)c2ccccc2n(c1=O)C)NCc1ccc2c(c1)OCO2
STK529283
Synonyms: (5Z)-1-(3-methoxyphenyl)-5-({[2-(pyridin-3-yl)piperidin-1-yl]amino}methylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1cccc(c1)N1C(=O)NC(=O)/C(=C/NN2CCCCC2c2cccnc2)/C1=O
STK529284
Synonyms: 2-(4-chlorophenyl)-N-(3-fluorophenyl)quinazolin-4-amine
Smiles: Clc1ccc(cc1)c1nc(Nc2cccc(c2)F)c2c(n1)cccc2
STK529285
Synonyms: 3-{[(E)-(3-bromo-2-hydroxyphenyl)methylidene]amino}-8-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cccc(c1O)Br
STK529286
Synonyms: 5-{[(2-bromoethyl)amino]methylidene}pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: BrCCNC=C1C(=O)NC(=O)NC1=O
STK529287
Synonyms: 2-(acetylamino)-4,6-dinitrophenylfuran-2-carboxylate
Smiles: CC(=O)Nc1cc(cc(c1OC(=O)c1ccco1)[N+](=O)[O-])[N+](=O)[O-]
STK529289
Synonyms: methyl5-methyl-3-({[4-(phenylcarbonyl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C(=O)c1ccccc1)cc(cc2)C
STK529291
Synonyms: (5Z)-1-(4-bromophenyl)-5-[(prop-2-en-1-ylamino)methylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: C=CCN/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)Br
STK529292
Synonyms: 3-methyl-7-octyl-8-{(2E)-2-[(3E)-4-phenylbut-3-en-2-ylidene]hydrazinyl}-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCn1c(N/N=C(/C=C/c2ccccc2)\C)nc2c1c(=O)[nH]c(=O)n2C
STK529293
Synonyms: N-[2-(2-methoxyphenyl)ethyl]-8-methyl-5H-pyrimido[5,4-b]indol-4-amine
Smiles: COc1ccccc1CCNc1ncnc2c1[nH]c1c2cc(cc1)C
STK529294
Synonyms: 10-(5-bromo-2-hydroxyphenyl)-11-hydroxy-6,7,8,10-tetrahydro-9H-indeno[1,2-b]quinolin-9-one
Smiles: Brc1ccc(c(c1)C1C2=C(CCCC2=O)N=C2C1=C(O)c1c2cccc1)O
STK529295
Synonyms: 2-(4-methoxyphenyl)-1-[2-(piperidin-1-yl)ethyl]-1H-imidazo[1,2-a]benzimidazole
Smiles: COc1ccc(cc1)c1cn2c(n1CCN1CCCCC1)nc1c2cccc1
STK529297
Synonyms: 4-(4-methylpyridinium-1-yl)-2-oxo-5-{(E)-[2-(pyridin-3-ylcarbonyl)hydrazinylidene]methyl}-1,3-thiazol-3-ide
Smiles: Cc1cc[n+](cc1)c1[n-]c(=O)sc1/C=N/NC(=O)c1cccnc1
STK529298
Synonyms: 3-{[(E)-(3-iodophenyl)methylidene]amino}-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Cc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1cccc(c1)I
STK529299
Synonyms: methyl5-methyl-3-{[(4-phenylpiperazin-1-yl)acetyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccccc1)cc(cc2)C
STK529300
Synonyms: methyl5-methyl-3-{[(4-oxopiperidin-1-yl)acetyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCC(=O)CC1)cc(cc2)C
STK529302
Synonyms: N-butyl-2-[(2,2-diphenylcyclopropyl)carbonyl]hydrazinecarboxamide
Smiles: CCCCNC(=O)NNC(=O)C1C[C@@]1(c1ccccc1)c1ccccc1
STK529305
Synonyms: 8-(decylsulfanyl)-3-methyl-7-nonyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCSc1nc2c(n1CCCCCCCCC)c(=O)[nH]c(=O)n2C
STK529306
Synonyms: methyl5-methoxy-3-{[(2-methylpiperidin-1-yl)acetyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCCCC1C)cc(cc2)OC
STK529307
Synonyms: N-{2-[(2,4-dichlorophenyl)(5-methylfuran-2-yl)methyl]-4,5-dimethoxyphenyl}-4-methylbenzenesulfonamide
Smiles: COc1cc(c(cc1OC)NS(=O)(=O)c1ccc(cc1)C)C(c1ccc(cc1Cl)Cl)c1ccc(o1)C
STK529308
Synonyms: N'-[(3E)-5-bromo-2-oxo-1-{[2-(pyridin-3-yl)piperidin-1-yl]methyl}-1,2-dihydro-3H-indol-3-ylidene]-2-({[(E)-(3,4-dimethoxyphenyl)methylidene]amino}oxy)acetohydrazide
Smiles: COc1cc(/C=N/OCC(=O)N/N=C/2\c3cc(Br)ccc3N(C2=O)CN2CCCCC2c2cccnc2)ccc1OC
STK529311
Synonyms: (2Z)-2-cyano-3-[(2-methoxy-4-nitrophenyl)amino]prop-2-enethioamide
Smiles: N#C/C(=C/Nc1ccc(cc1OC)[N+](=O)[O-])/C(=S)N
STK529313
Synonyms: 2-{1-oxo-1-[(triethylstannanyl)oxy]propan-2-yl}-1H-isoindole-1,3(2H)-dione
Smiles: CC[Sn](OC(=O)C(N1C(=O)c2c(C1=O)cccc2)C)(CC)CC
STK529314
Synonyms: (2Z)-3-(3,5-dibromo-4-hydroxyphenyl)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C/c1cc(Br)c(c(c1)Br)O)/c1scc(n1)c1cccc(c1)[N+](=O)[O-]
STK529315
Synonyms: 8-[(2-aminoethyl)amino]-7-hexadecyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCCCCCn1c(NCCN)nc2c1c(=O)[nH]c(=O)n2C
STK529316
Synonyms: 7-(3-ethoxy-4-hydroxyphenyl)-6H,7H,8H-pyrano[3,2-c:5,6-c']dichromene-6,8-dione
Smiles: CCOc1cc(ccc1O)C1c2c(=O)oc3c(c2Oc2c1c(=O)oc1c2cccc1)cccc3
STK529319
Synonyms: 1-ethyl-4-hydroxy-2-oxo-N-(4-oxo-2-pentylquinazolin-3(4H)-yl)-1,2-dihydroquinoline-3-carboxamide
Smiles: CCCCCc1nc2ccccc2c(=O)n1NC(=O)c1c(O)c2ccccc2n(c1=O)CC
STK529320
Synonyms: 2-[(2-methylphenyl)(phenyl)methylidene]-1H-indene-1,3(2H)-dione
Smiles: Cc1ccccc1/C(=C/1\C(=O)c2c(C1=O)cccc2)/c1ccccc1
STK529323
Synonyms: 6-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-4-(2-chlorophenyl)-5-cyano-2-methyl-N-(2-methylphenyl)pyridine-3-carboxamide
Smiles: N#Cc1c(SCC(=O)c2ccc(cc2)Br)nc(c(c1c1ccccc1Cl)C(=O)Nc1ccccc1C)C
STK529324
Synonyms: 8-methoxy-3-{[(E)-(3-methoxyphenyl)methylidene]amino}-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: COc1cccc(c1)/C=N/n1c(=O)[nH]c2c(c1=O)[nH]c1c2cc(cc1)OC
STK529326
Synonyms: (7Z)-7-(5-bromo-2-hydroxybenzylidene)-3,4-diphenyl-4H-[1,3]thiazolo[2,3-c][1,2,4]triazin-6(7H)-one
Smiles: Brc1ccc(c(c1)/C=c/1\sc2=NN=C(C(n2c1=O)c1ccccc1)c1ccccc1)O
STK529327
Synonyms: 2-methyl-3-{[(E)-(4-nitrophenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: [O-][N+](=O)c1ccc(cc1)/C=N/n1c(C)nc2c(c1=O)[nH]c1c2cccc1
STK529329
Synonyms: 3-{[(E)-(4-hydroxy-3-methoxyphenyl)methylidene]amino}-8-methoxy-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: COc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc(c(c1)OC)O
STK529330
Synonyms: N-(3,4-dichlorophenyl)-2,5-dimethyl-4-oxopiperidine-1-carboxamide
Smiles: O=C1CC(C)N(CC1C)C(=O)Nc1ccc(c(c1)Cl)Cl
STK529332
Synonyms: ethyl3-({[4-(9H-fluoren-9-yl)piperazin-1-yl]acetyl}amino)-5-methoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C1c3ccccc3c3c1cccc3)cc(cc2)OC
STK529333
Synonyms: methyl3-({[4-(9H-fluoren-9-yl)piperazin-1-yl]acetyl}amino)-5-methyl-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)C1c3ccccc3c3c1cccc3)cc(cc2)C
STK529335
Synonyms: 8-(benzylamino)-7-heptyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCn1c(NCc2ccccc2)nc2c1c(=O)[nH]c(=O)n2C
STK529337
Synonyms: 2-(2-chlorophenyl)-4-[(2E)-2-(4-methoxybenzylidene)hydrazinyl]quinazoline
Smiles: COc1ccc(cc1)/C=N/Nc1nc(nc2c1cccc2)c1ccccc1Cl
STK529338
Synonyms: 2-(3,4-dichlorophenyl)-4-(2-methylphenoxy)quinazoline
Smiles: Cc1ccccc1Oc1nc(nc2c1cccc2)c1ccc(c(c1)Cl)Cl
STK529342
Synonyms: 5-chloro-3-(morpholin-4-ylmethyl)-1,3-benzoxazol-2(3H)-one
Smiles: Clc1ccc2c(c1)n(CN1CCOCC1)c(=O)o2
STK529343
Synonyms: 2-phenyl-4-{[(tributylstannanyl)oxy]carbonyl}quinoline
Smiles: CCCC[Sn](OC(=O)c1cc(nc2c1cccc2)c1ccccc1)(CCCC)CCCC
STK529345
Synonyms: 2,5-dimethyl-1-(10H-phenothiazin-10-ylcarbonyl)piperidin-4-one
Smiles: O=C1CC(C)N(CC1C)C(=O)N1c2ccccc2Sc2c1cccc2
STK529346
Synonyms: 4-[2-amino-3-cyano-4,4-bis(trifluoromethyl)-5,6,7,8-tetrahydroquinolin-1(4H)-yl]-N-(6-methoxypyridazin-3-yl)benzenesulfonamide
Smiles: N#CC1=C(N)N(c2ccc(cc2)S(=O)(=O)Nc2ccc(nn2)OC)C2=C(C1(C(F)(F)F)C(F)(F)F)CCCC2
STK529347
Synonyms: 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-(pyridin-2-ylmethyl)-1,4-dihydroquinoline-3-carboxamide
Smiles: CCn1cc(C(=O)NCc2ccccn2)c(=O)c2c1cc(N1CCN(CC1)C)c(c2)F
STK529349
Synonyms: N-{2-[1-(2,6-dimethylphenyl)-1H-tetrazol-5-yl]butan-2-yl}-N-nitroso-3-(trifluoromethyl)aniline
Smiles: O=NN(C(c1nnnn1c1c(C)cccc1C)(CC)C)c1cccc(c1)C(F)(F)F
STK529350
Synonyms: 4-[(E)-{2-[(2E)-2-(2-hydroxybenzylidene)hydrazinyl]-4-phenyl-1,3-selenazol-5-yl}diazenyl]benzenesulfonamide
Smiles: Oc1ccccc1/C=N/Nc1[se]c(c(n1)c1ccccc1)/N=N/c1ccc(cc1)S(=O)(=O)N
STK529351
Synonyms: 2-(thiophen-2-yl)-2,3-dihydroquinazolin-4(1H)-one
Smiles: O=C1NC(Nc2c1cccc2)c1cccs1
STK529352
Synonyms: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2-methoxyphenyl)-1,3-dioxo-2,3-dihydro-1H-benzo[de]isoquinoline-6-carboxamide
Smiles: COc1cc(CCNC(=O)c2ccc3c4c2cccc4c(=O)n(c3=O)c2ccccc2OC)ccc1OC
STK529355
Synonyms: ethyl4-[(5E)-5-(3,4-dimethoxybenzylidene)-2,4,6-trioxotetrahydropyrimidin-1(2H)-yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)N1C(=O)NC(=O)/C(=C\c2ccc(c(c2)OC)OC)/C1=O
STK529358
Synonyms: 5-[(4-methoxyphenyl)amino]-3-[(2-phenylethyl)amino]-6H-anthra[1,9-cd][1,2]oxazol-6-one
Smiles: COc1ccc(cc1)Nc1cc(NCCc2ccccc2)c2c3c1C(=O)c1ccccc1c3on2
STK529359
Synonyms: (2E,7E)-2,7-bis(thiophen-2-ylmethylidene)cycloheptanone
Smiles: O=C1/C(=C/c2cccs2)/CCCC/C/1=C\c1cccs1
STK529360
Synonyms: diphenyl{[(3-nitrophenyl)amino](phenyl)methyl}phosphonate
Smiles: [O-][N+](=O)c1cccc(c1)NC(P(=O)(Oc1ccccc1)Oc1ccccc1)c1ccccc1
STK529362
Synonyms: 8-[(2-aminoethyl)amino]-3-methyl-7-nonyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCn1c(NCCN)nc2c1c(=O)[nH]c(=O)n2C
STK529364
Synonyms: [2-(2-{[6-bromo-2-(thiophen-2-yl)quinolin-4-yl]carbonyl}hydrazinylidene)-7,7-dimethylbicyclo[2.2.1]hept-1-yl]methanesulfonicacid
Smiles: Brc1ccc2c(c1)c(cc(n2)c1cccs1)C(=O)N/N=C/1\CC2C(C1(CC2)CS(=O)(=O)O)(C)C
STK529365
Synonyms: N-(2,4-dichlorophenyl)-1-hexyl-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxamide
Smiles: CCCCCCn1c(=O)c(C(=O)Nc2ccc(cc2Cl)Cl)c(c2c1cccc2)O
STK529366
Synonyms: 3-(4-chlorophenyl)-5-(4-nitrophenyl)-1-phenyl-4,5-dihydro-1H-pyrazole
Smiles: Clc1ccc(cc1)C1=NN(C(C1)c1ccc(cc1)[N+](=O)[O-])c1ccccc1
STK529368
Synonyms: ethyl3-{[(4-carbamoylpiperidin-1-yl)acetyl]amino}-5-methoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCC(CC1)C(=O)N)cc(cc2)OC
STK529371
Synonyms: 7-(3-bromobenzyl)-3-methyl-8-{(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl}-3,7-dihydro-1H-purine-2,6-dione
Smiles: Brc1cccc(c1)Cn1c(N/N=C(/c2ccc(cc2)[N+](=O)[O-])\C)nc2c1c(=O)[nH]c(=O)n2C
STK529372
Synonyms: N'-[(4-aminophenyl)sulfonyl]-4-hydroxy-2-oxo-1-propyl-1,2-dihydroquinoline-3-carbohydrazide
Smiles: CCCn1c(=O)c(C(=O)NNS(=O)(=O)c2ccc(cc2)N)c(c2c1cccc2)O
STK529373
Synonyms: 2-hydroxy-5-[(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]benzoicacid
Smiles: OC(=O)c1cc(ccc1O)Nc1ccc2c(c1[N+](=O)[O-])non2
STK529375
Synonyms: 3-[4-(pyridin-4-yl)pyridinium-1-yl]propane-1-sulfonate
Smiles: [O-]S(=O)(=O)CCC[n+]1ccc(cc1)c1ccncc1
STK529376
Synonyms: 7-hexadecyl-3-methyl-8-[(2-oxopropyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCCCCCn1c(SCC(=O)C)nc2c1c(=O)[nH]c(=O)n2C
STK529379
Synonyms: 5-bromobenzo[1,2-c:3,4-c']bis[1,2,5]oxadiazole1-oxide
Smiles: Brc1cc2no[n+](c2c2c1non2)[O-]
STK529380
Synonyms: 1-(5-methoxy-1H-indol-3-yl)-2-(morpholin-4-yl)ethanone
Smiles: COc1ccc2c(c1)c(c[nH]2)C(=O)CN1CCOCC1
STK529381
Synonyms: 3,7-dimethyl-8-[(2-methylpropyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: CC(CSc1nc2c(n1C)c(=O)[nH]c(=O)n2C)C
STK529385
Synonyms: N'-[(3E)-2-oxo-1-{[2-(pyridin-3-yl)piperidin-1-yl]methyl}-1,2-dihydro-3H-indol-3-ylidene]pyridine-4-carbohydrazide
Smiles: O=C1N(CN2CCCCC2c2cccnc2)c2c(/C/1=N\NC(=O)c1ccncc1)cccc2
STK529386
Synonyms: N-(1-{(2E)-2-[4-methoxy-3-(morpholin-4-ylmethyl)benzylidene]hydrazinyl}-1-oxopropan-2-yl)benzamide(non-preferredname)
Smiles: COc1ccc(cc1CN1CCOCC1)/C=N/NC(=O)C(NC(=O)c1ccccc1)C
STK529387
Synonyms: 4-nitro-N'-[(1E)-1-(3-oxo-3H-benzo[f]chromen-2-yl)ethylidene]benzohydrazide
Smiles: O=C(c1ccc(cc1)[N+](=O)[O-])N/N=C(/c1cc2c(oc1=O)ccc1c2cccc1)\C
STK529389
Synonyms: 3-[2-(dimethylamino)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: CN(CCn1cnc2c(c1=O)[nH]c1c2cccc1)C
STK529391
Synonyms: (5Z)-1,3,5-triphenyl-5-(2-phenylhydrazinylidene)pentan-1-one
Smiles: O=C(c1ccccc1)CC(c1ccccc1)C/C(=N/Nc1ccccc1)/c1ccccc1
STK529392
Synonyms: 6-methoxy-3-{4-[4-(phenylsulfanyl)phenyl]-1,3-thiazol-2-yl}-2H-chromen-2-one
Smiles: COc1ccc2c(c1)cc(c(=O)o2)c1scc(n1)c1ccc(cc1)Sc1ccccc1
STK529393
Synonyms: 4-[(2E)-2-(2,4-dichlorobenzylidene)hydrazinyl][1,2,4]triazolo[4,3-a]quinoxaline
Smiles: Clc1ccc(c(c1)Cl)/C=N/Nc1nc2ccccc2n2c1nnc2
STK529394
Synonyms: methyl3-{[(4-phenylpiperazin-1-yl)acetyl]amino}-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccccc1)cccc2
STK529395
Synonyms: 7-hexadecyl-8-hydrazinyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCCCCCCCn1c(NN)nc2c1c(=O)[nH]c(=O)n2C
STK529396
Synonyms: 5-[(4-chlorophenyl)amino]-3-(methylamino)-6H-anthra[1,9-cd][1,2]oxazol-6-one
Smiles: CNc1cc(Nc2ccc(cc2)Cl)c2c3c1noc3c1c(C2=O)cccc1
STK529398
Synonyms: 2-[{[dimethyl(oxido)-lambda~6~-sulfanylidene]amino}(diphenyl)-lambda~5~-phosphanylidene]-1-(4-nitrophenyl)-2-[(E)-phenyldiazenyl]ethanone
Smiles: O=C(C(=P(c1ccccc1)(c1ccccc1)N=S(=O)(C)C)/N=N/c1ccccc1)c1ccc(cc1)[N+](=O)[O-]
STK529400
Synonyms: 3-{[(1E,2E)-3-(1,3-benzodioxol-5-yl)-2-methylprop-2-en-1-ylidene]amino}-8-methoxy-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Smiles: COc1ccc2c(c1)c1[nH]c(=O)n(c(=O)c1[nH]2)/N=C/C(=C/c1ccc2c(c1)OCO2)/C
STK529402
Synonyms: 4-(3-methylpyridinium-1-yl)-2-oxo-5-{(E)-[2-(pyridin-4-ylcarbonyl)hydrazinylidene]methyl}-1,3-thiazol-3-ide
Smiles: Cc1ccc[n+](c1)c1[n-]c(=O)sc1/C=N/NC(=O)c1ccncc1
STK529403
Synonyms: 3-[2-(4-fluorophenyl)ethyl]-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Fc1ccc(cc1)CCn1cnc2c(c1=O)[nH]c1c2cc(cc1)C
STK529405
Synonyms: N-{2-[(2,4-dichlorophenyl)(hydroxy)methyl]-4,5-dimethoxyphenyl}-4-methylbenzenesulfonamide
Smiles: COc1cc(c(cc1OC)NS(=O)(=O)c1ccc(cc1)C)C(c1ccc(cc1Cl)Cl)O
STK529407
Synonyms: 1,1-bis(diethylamino)-N'-(4-nitrophenyl)phosphanecarbohydrazonamideoxide
Smiles: CCN(P(=O)(/C(=N/Nc1ccc(cc1)[N+](=O)[O-])/N)N(CC)CC)CC
STK529409
Synonyms: diphenyl(5,7,8,9-tetrahydro-6H-dibenzo[c,h]xanthen-7-yl)phosphaneoxide
Smiles: O=P(C1C2=C(OC3=C1CCc1c3cccc1)c1c(CC2)cccc1)(c1ccccc1)c1ccccc1
STK529410
Synonyms: 1-(1,1,1,3,3,3-hexafluoro-2-phenoxypropan-2-yl)-3-(3-methyl-1-phenyl-1H-pyrazol-5-yl)urea
Smiles: Cc1cc(n(n1)c1ccccc1)NC(=O)NC(C(F)(F)F)(C(F)(F)F)Oc1ccccc1
STK529411
Synonyms: 3-chloro-N-[(1Z)-4,4,6-trimethyl-4,5-dihydro-1H-[1,2]dithiolo[3,4-c]quinolin-1-ylidene]aniline
Smiles: Clc1cccc(c1)/N=c/1\ssc2c1c1cccc(c1NC2(C)C)C
STK529412
Synonyms: (2E)-3-[(2-methyl-4-nitrophenyl)amino]-2-[4-(6-nitro-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(cc1C)[N+](=O)[O-])/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]
STK529415
Synonyms: methyl5-chloro-3-({[4-(2-fluorophenyl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1ccccc1F)cc(cc2)Cl
STK529417
Synonyms: 2-(2,4-dichlorophenyl)-4-{(2E)-2-[1-(4-methylphenyl)ethylidene]hydrazinyl}quinazoline
Smiles: Cc1ccc(cc1)/C(=N/Nc1nc(nc2c1cccc2)c1ccc(cc1Cl)Cl)/C
STK529418
Synonyms: N-[3-(2,2-diphenylhydrazinyl)-3-oxopropyl]-2-{[(4-methoxyphenyl)carbonyl]amino}benzamide(non-preferredname)
Smiles: COc1ccc(cc1)C(=O)Nc1ccccc1C(=O)NCCC(=O)NN(c1ccccc1)c1ccccc1
STK529419
Synonyms: Nalpha-(cyclohexylcarbamoyl)-N-(4-methoxyphenyl)tryptophanamide
Smiles: COc1ccc(cc1)NC(=O)C(Cc1c[nH]c2c1cccc2)NC(=O)NC1CCCCC1
STK529423
Synonyms: (3E)-3-[(3-methoxyphenyl)imino]-2-(4-nitrophenyl)-2,3-dihydro-1H-inden-1-one
Smiles: COc1cccc(c1)/N=C/1\C(c2ccc(cc2)[N+](=O)[O-])C(=O)c2c1cccc2
STK529424
Synonyms: methyl(2E)-2-(4-chlorobenzylidene)-5-(4-fluorophenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)F)c(=O)/c(=C\c1ccc(cc1)Cl)/s2
STK529425
Synonyms: 4-(4-methylphenyl)-4-oxobutane-1,1,2,2-tetracarbonitrile
Smiles: N#CC(C(C#N)C#N)(CC(=O)c1ccc(cc1)C)C#N
STK529427
Synonyms: methyl5-bromo-3-({[4-(7-ethyl-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1nc3c(n1CC)c(=O)[nH]c(=O)n3C)cc(cc2)Br
STK529428
Synonyms: N-(4-oxo-4,6-dihydro-3H-spiro[benzo[h]quinazoline-5,1'-cyclohexan]-3-yl)acetamide
Smiles: CC(=O)Nn1cnc2c(c1=O)C1(CCCCC1)Cc1c2cccc1
STK529429
Synonyms: [3-amino-6-cyclopropyl-4-(2-fluorophenyl)thieno[2,3-b]pyridin-2-yl](4-bromophenyl)methanone
Smiles: Brc1ccc(cc1)C(=O)c1sc2c(c1N)c(cc(n2)C1CC1)c1ccccc1F
STK529431
Synonyms: ethyl3-({[4-(ethoxycarbonyl)piperidin-1-yl]acetyl}amino)-5-methoxy-1H-indole-2-carboxylate
Smiles: CCOC(=O)C1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc(OC)cc2)C(=O)OCC
STK529432
Synonyms: 3-acetyl-2-oxo-2H-chromen-4-ylborodifluoridate
Smiles: FB(Oc1c(C(=O)C)c(=O)oc2c1cccc2)F
STK529435
Synonyms: 6,7-dimethoxy-3-[(2-methoxy-4-nitrophenyl)amino]-2-benzofuran-1(3H)-one
Smiles: COc1cc(ccc1NC1OC(=O)c2c1ccc(c2OC)OC)[N+](=O)[O-]
STK529436
Synonyms: 4-(3-benzylpyridinium-1-yl)-5-formyl-2-oxo-1,3-thiazol-3-ide
Smiles: O=Cc1sc(=O)[n-]c1[n+]1cccc(c1)Cc1ccccc1
STK529438
Synonyms: diethyl2-{6-methoxy-2,2-dimethyl-1-[(2E)-3-phenylprop-2-enoyl]-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene}-1,3-dithiole-4,5-dicarboxylate
Smiles: CCOC(=O)C1=C(S/C(=C/2\c3cc(OC)ccc3N(C(C2=S)(C)C)C(=O)/C=C/c2ccccc2)/S1)C(=O)OCC
STK529439
Synonyms: 2-(furan-2-yl)-10-iminotetrahydro-8a,3-(epoxymethano)chromene-3,4,4(2H,4aH)-tricarbonitrile
Smiles: N#CC12C(=N)OC3(OC1c1ccco1)C(C2(C#N)C#N)CCCC3
STK529440
Synonyms: N-[(4Z)-4-[4-(dimethylamino)benzylidene]-5-oxo-1-(2,4,6-trichlorophenyl)-4,5-dihydro-1H-pyrazol-3-yl]-3-nitrobenzamide
Smiles: Clc1cc(Cl)c(c(c1)Cl)N1N=C(/C(=C/c2ccc(cc2)N(C)C)/C1=O)NC(=O)c1cccc(c1)[N+](=O)[O-]
STK529441
Synonyms: 2-{[5-(4,5-dimethoxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)-4-hydroxy-6-oxo-1-phenyl-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-phenylacetamide
Smiles: COc1c(OC)ccc2c1C(=O)OC2c1c(O)nc(n(c1=O)c1ccccc1)SCC(=O)Nc1ccccc1
STK529442
Synonyms: 2,6-dichloro-N~4~-[(E)-pyridin-3-ylmethylidene]benzene-1,4-diamine
Smiles: Nc1c(Cl)cc(cc1Cl)/N=C/c1cccnc1
STK529443
Synonyms: (7E)-7-benzylidene-3,4-diphenyl-4H-[1,3]thiazolo[2,3-c][1,2,4]triazin-6(7H)-one
Smiles: O=c1/c(=C\c2ccccc2)/sc2=NN=C(C(n12)c1ccccc1)c1ccccc1
STK529444
Synonyms: N'-[(2E)-3-(furan-2-yl)prop-2-enoyl]-2-hydroxy-N'-phenyl-2-propylpentanehydrazide
Smiles: CCCC(C(=O)NN(c1ccccc1)C(=O)/C=C/c1ccco1)(CCC)O
STK529445
Synonyms: 8-chloro-3-[2-(piperidin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Clc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)CCN1CCCCC1
STK529446
Synonyms: 2-(4-{3-[2-(4-bromophenyl)-1H-imidazo[1,2-a]benzimidazol-1-yl]propyl}piperazin-1-yl)ethanol
Smiles: OCCN1CCN(CC1)CCCn1c(cn2c1nc1c2cccc1)c1ccc(cc1)Br
STK529447
Synonyms: (2Z)-3-[(2,5-dimethylphenyl)amino]-2-[4-(6-nitro-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C/Nc1cc(C)ccc1C)/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]
STK529448
Synonyms: 2-{[(1E,2Z)-2-(2,2-dimethyl-6-phenyl-4H-1,3-dioxin-4-ylidene)ethylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Smiles: NC(=O)c1c(/N=C/C=C\2/C=C(OC(O2)(C)C)c2ccccc2)sc2c1CCCC2
STK529449
Synonyms: 5,9,13,17-tetrakis(2-methylpropoxy)-1,21,23,25-tetrapropyl-1H,21H,23H,25H-19,3:20,2-di(metheno)[1,3,2]benzodioxaborocino[9',8':4,5][1,3,2]benzodioxaborocino[9,8-d][1,3,2]dioxaborocino[5,4-i][1,3,2]ben
Smiles: CCCC1c2cc3c4cc2OB(Oc2c1cc1c(c2)OB(OCC(C)C)Oc2c(C1CCC)cc1C(c5cc(C3CCC)c(OB(O4)OCC(C)C)cc5OB(Oc1c2)OCC(C)C)CCC)OCC(C)C
STK529450
Synonyms: N-(1,3-benzodioxol-5-ylmethyl)-4-hydroxy-1-(3-methylbutyl)-2-oxo-1,2-dihydroquinoline-3-carboxamide
Smiles: CC(CCn1c(=O)c(C(=O)NCc2ccc3c(c2)OCO3)c(c2c1cccc2)O)C
STK529451
Synonyms: 7-heptyl-8-[(2E)-2-(2-hydroxybenzylidene)hydrazinyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCn1c(N/N=C/c2ccccc2O)nc2c1c(=O)[nH]c(=O)n2C
STK529452
Synonyms: 5-(furan-2-ylmethylidene)-1,3-bis(2-methylphenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: O=C1/C(=C/c2ccco2)/C(=O)N(C(=S)N1c1ccccc1C)c1ccccc1C
STK529454
Synonyms: 1-chloro-3-{[(2Z)-3-methyl-1,3-benzothiazol-2(3H)-ylidene]amino}propan-2-ol
Smiles: ClCC(C/N=c/1\sc2c(n1C)cccc2)O
STK529455
Synonyms: methyl4-{[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)(phenyl)methyl]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)NC(c1c(=O)n(n(c1C)C)c1ccccc1)c1ccccc1
STK529459
Synonyms: 7-{3-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-methoxyphenyl}-6H,7H,8H-pyrano[3,2-c:5,6-c']dichromene-6,8-dione
Smiles: COc1ccc(cc1CSc1nc2c(s1)cccc2)C1c2c(=O)oc3c(c2Oc2c1c(=O)oc1c2cccc1)cccc3
STK529460
Synonyms: pentacyclo[4.2.0.0~2,5~.0~3,8~.0~4,7~]octane-1,4-dicarboxylicacid
Smiles: OC(=O)C12C3C4C2C2C1C3C42C(=O)O
STK529461
Synonyms: 2-tert-butyl-1H-naphtho[2,3-g]indazole-3,6,11(2H)-trione
Smiles: O=c1c2c(ccc3c2[nH]n(c3=O)C(C)(C)C)c(=O)c2c1cccc2
STK529462
Synonyms: 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]-1,4-dihydroquinoline-3-carboxamide
Smiles: CCn1cc(C(=O)Nc2nnc(s2)C(C)C)c(=O)c2c1cc(N1CCN(CC1)C)c(c2)F
STK529463
Synonyms: 1,3-dimethyl-8-[(1E)-3-(2-methylphenyl)triaz-1-en-1-yl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cc1ccccc1N/N=N/c1[nH]c2c(n1)n(C)c(=O)n(c2=O)C
STK529464
Synonyms: 1-ethyl-6-fluoro-7-(4-methylpiperazin-1-yl)-N-nonyl-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CCCCCCCCCNC(=O)c1cn(CC)c2c(c1=O)cc(c(c2)N1CCN(CC1)C)F
STK529465
Synonyms: N-(1,3-benzodioxol-5-ylmethyl)-4-hydroxy-1-(2-methylpropyl)-2-oxo-1,2-dihydroquinoline-3-carboxamide
Smiles: CC(Cn1c(=O)c(C(=O)NCc2ccc3c(c2)OCO3)c(c2c1cccc2)O)C
STK529466
Synonyms: (2E)-2-[(2E)-3-(5-nitrofuran-2-yl)prop-2-en-1-ylidene][1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Smiles: [O-][N+](=O)c1ccc(o1)/C=C/C=c\1/sc2n(c1=O)c1c(n2)cccc1
STK529467
Synonyms: 2,2,4,4,6,6-hexakis(4-bromophenoxy)-1,3,5,2lambda~5~,4lambda~5~,6lambda~5~-triazatriphosphinine
Smiles: Brc1ccc(cc1)OP1(=NP(=NP(=N1)(Oc1ccc(cc1)Br)Oc1ccc(cc1)Br)(Oc1ccc(cc1)Br)Oc1ccc(cc1)Br)Oc1ccc(cc1)Br
STK529468
Synonyms: methyl5-bromo-3-({[4-(4-fluorophenyl)-3,6-dihydropyridin-1(2H)-yl]acetyl}amino)-1H-indole-2-carboxylate
Smiles: COC(=O)c1[nH]c2c(c1NC(=O)CN1CCC(=CC1)c1ccc(cc1)F)cc(cc2)Br
STK529469
Synonyms: 7-[(2E)-but-2-en-1-yl]-8-(decylsulfanyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: CCCCCCCCCCSc1nc2c(n1C/C=C/C)c(=O)[nH]c(=O)n2C
STK529470
Synonyms: 8-methyl-3-[3-(morpholin-4-yl)propyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Cc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)CCCN1CCOCC1
STK529474
Synonyms: methyl3-({[4-(2-hydroxyethyl)piperazin-1-yl]acetyl}amino)-5-methyl-1H-indole-2-carboxylate
Smiles: OCCN1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc(C)cc2)C(=O)OC
STK529475
Synonyms: 8-bromo-3-[2-(piperidin-1-yl)ethyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Smiles: Brc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)CCN1CCCCC1