FULL DB

Total number of items: 1633432
Total number of pages: 1634 ( 1000 items on each page )

STK760758
Synonyms: [4-amino-6-(piperidin-1-yl)-1,3,5-triazin-2-yl]methylcarbamimidothioate
Smiles: NC(=N)SCc1nc(N)nc(n1)N1CCCCC1

STK760762
Synonyms: 2-{(E)-[2-(morpholin-4-yl)cyclopent-2-en-1-ylidene]methyl}-1H-benzimidazole
Smiles: O1CCN(CC1)C1=CCC/C/1=C\c1nc2c([nH]1)cccc2

STK760765
Synonyms: 6-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-9H-purine
Smiles: C1Oc2c(O1)cc(cc2)CSc1ncnc2c1nc[nH]2

STK760767
Synonyms: 8-[(1-benzyl-1H-benzimidazol-2-yl)sulfanyl]-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
Smiles: Cn1c(=O)n(C)c(=O)c2c1nc(n2C)Sc1nc2c(n1Cc1ccccc1)cccc2

STK760769
Synonyms: N-(2-ethyl-6-methylphenyl)-2-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetamide
Smiles: CCc1cccc(c1NC(=O)CSc1nc2c(n1C)c(=O)n(c(=O)n2C)C)C

STK760770
Synonyms: 1,3,7-trimethyl-8-(methylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: CSc1nc2c(n1C)c(=O)n(c(=O)n2C)C

STK760771
Synonyms: 3-amino-4-(4-nitrophenyl)-5-oxo-5H-indeno[1,2-b]thieno[3,2-e]pyridine-2-carboxamide
Smiles: [O-][N+](=O)c1ccc(cc1)c1c2C(=O)c3c(c2nc2c1c(N)c(s2)C(=O)N)cccc3

STK760772
Synonyms: N-[5-({2-[(3-methylphenyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-2-(morpholin-4-yl)acetamide
Smiles: O=C(Nc1nnc(s1)SCC(=O)Nc1cccc(c1)C)CN1CCOCC1

STK760773
Synonyms: 2-({5-[(methylsulfonyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)-N-phenylacetamide
Smiles: O=C(Nc1ccccc1)CSc1nnc(s1)NS(=O)(=O)C

STK760774
Synonyms: N-cyclohexyl-2-phenyl[1]benzofuro[3,2-d]pyrimidin-4-amine
Smiles: C1CCC(CC1)Nc1nc(nc2c1oc1c2cccc1)c1ccccc1

STK760780
Synonyms: N-(3-methoxyphenyl)-2-({5-[(methylsulfonyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetamide
Smiles: COc1cccc(c1)NC(=O)CSc1nnc(s1)NS(=O)(=O)C

STK760782
Synonyms: {[5-(ethoxycarbonyl)-6-methyl-4-phenyl-1,4-dihydropyrimidin-2-yl]sulfanyl}aceticacid
Smiles: CCOC(=O)C1=C(C)NC(=NC1c1ccccc1)SCC(=O)O

STK675609
Synonyms: 1-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]propan-1-one
Smiles: CCC(=O)N1CCN(CC1)c1nc2c(s1)cccc2

STK760795
Synonyms: 4-acetyl-5-(4-fluorophenyl)-3-hydroxy-1-(4-hydroxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Oc1ccc(cc1)N1C(=O)C(=C(C1c1ccc(cc1)F)C(=O)C)O

STK760800
Synonyms: [2-(4-chlorophenyl)-5-oxo-1-phenyl-4-(phenylamino)-2,5-dihydro-1H-pyrrol-3-yl]aceticacid
Smiles: OC(=O)CC1=C(Nc2ccccc2)C(=O)N(C1c1ccc(cc1)Cl)c1ccccc1

STK760806
Synonyms: 4-acetyl-3-hydroxy-5-(4-methylphenyl)-1-(pyridin-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Cc1ccc(cc1)C1N(c2ccccn2)C(=O)C(=C1C(=O)C)O

STK760809
Synonyms: (1E)-N'-(4-nitrophenyl)ethanimidamide
Smiles: C/C(=N\c1ccc(cc1)[N+](=O)[O-])/N

STK760813
Synonyms: 1-methyl-N'-[(4-{[(1-methyl-1H-imidazol-2-yl)sulfanyl]methyl}phenyl)carbonyl]-1H-pyrazole-5-carbohydrazide
Smiles: O=C(c1ccc(cc1)CSc1nccn1C)NNC(=O)c1ccnn1C

STK760815
Synonyms: 2,5-diamino-6a,6b-diphenyl-3,4,6a,6b-tetrahydro-2a,4a-diazacyclopenta[cd]pentalene-1,6-dicarbonitrile
Smiles: N#CC1=C(N)N2C3(C1(c1ccccc1)C(=C(N3CC2)N)C#N)c1ccccc1

STK675619
Synonyms: 4-chloro-1-(1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)butan-1-one
Smiles: ClCCCC(=O)N1CCc2c(C1)c1ccccc1[nH]2

STK760824
Synonyms: 1,3-dimethyl-5-(naphthalen-1-ylmethyl)-5-[2-(pyridin-4-yl)ethyl]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: O=C1N(C)C(=O)C(C(=O)N1C)(CCc1ccncc1)Cc1cccc2c1cccc2

STK760825
Synonyms: 2-[2-(ethylsulfanyl)-1H-benzimidazol-1-yl]-1-(piperidin-1-yl)ethanone
Smiles: CCSc1nc2c(n1CC(=O)N1CCCCC1)cccc2

STK760827
Synonyms: (5-methyl-2-phenylfuran-3-yl)[4-(4-nitrophenyl)piperazin-1-yl]methanone
Smiles: Cc1cc(c(o1)c1ccccc1)C(=O)N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-]

STK760830
Synonyms: 1,3,3,4-tetramethyl-3,4-dihydrobenzo[h]isoquinoline
Smiles: CC1=NC(C)(C)C(c2c1c1ccccc1cc2)C

STK760831
Synonyms: 5,7-di-tert-butyl-2-(2-methoxyphenyl)-2,3-dihydro-1,3-benzoxazole
Smiles: COc1ccccc1C1Nc2c(O1)c(cc(c2)C(C)(C)C)C(C)(C)C

STK675626
Synonyms: 1-[(2-chloroethyl)sulfinyl]octane
Smiles: CCCCCCCCS(=O)CCCl

STK675627
Synonyms: 1-[(2-bromoethyl)sulfonyl]octane
Smiles: CCCCCCCCS(=O)(=O)CCBr

STK675628
Synonyms: 1-[(4-chlorobutyl)sulfonyl]octane
Smiles: CCCCCCCCS(=O)(=O)CCCCCl

STK675629
Synonyms: 1-[(chloromethyl)sulfonyl]octane
Smiles: CCCCCCCCS(=O)(=O)CCl

STK760836
Synonyms: 6-(trifluoromethyl)-3-[3-(trifluoromethyl)phenyl][1,2,4]triazolo[4,3-a]pyridine
Smiles: FC(c1cccc(c1)c1nnc2n1cc(cc2)C(F)(F)F)(F)F

STK760845
Synonyms: sulfanediyldiethane-2,1-diyldicarbamimidothioate
Smiles: NC(=N)SCCSCCSC(=N)N

STK675632
Synonyms: 1-[(2-chloroethyl)sulfonyl]dodecane
Smiles: CCCCCCCCCCCCS(=O)(=O)CCCl

STK760848
Synonyms: 6-nitro-1-[(4-nitrobenzyl)oxy]-1H-benzotriazole
Smiles: [O-][N+](=O)c1ccc(cc1)COn1nnc2c1cc(cc2)[N+](=O)[O-]

STK760849
Synonyms: 2-[(6-nitro-1H-benzotriazol-1-yl)oxy]-1-(10H-phenothiazin-10-yl)ethanone
Smiles: O=C(N1c2ccccc2Sc2c1cccc2)COn1nnc2c1cc(cc2)[N+](=O)[O-]

STK760850
Synonyms: 4-hydroxy-1,3-dimethylpiperidine-4-carbonitrile
Smiles: N#CC1(O)CCN(CC1C)C

STK760852
Synonyms: 2-methylquinolin-6-amine
Smiles: Nc1ccc2c(c1)ccc(n2)C

STK760854
Synonyms: N-(4-oxo-4,5-dihydro-1,3-thiazol-2-yl)-2-(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)acetamide
Smiles: O=C(NC1=NC(=O)CS1)CSc1nnc2c(n1)[nH]c1c2cccc1

STK675637
Synonyms: 2-chloro-1-[4-(2-fluoro-4-nitrophenyl)piperazin-1-yl]ethanone
Smiles: ClCC(=O)N1CCN(CC1)c1ccc(cc1F)[N+](=O)[O-]

STK760862
Synonyms: N-(4-amino-1,2,5-oxadiazol-3-yl)-2-(1,3-benzothiazol-2-ylsulfanyl)acetamide
Smiles: O=C(Nc1nonc1N)CSc1nc2c(s1)cccc2

STK760863
Synonyms: 2-{4-[chloro(difluoro)methoxy]phenyl}-4,6-dinitro-1,2-benzothiazol-3(2H)-one
Smiles: [O-][N+](=O)c1cc(cc2c1c(=O)n(s2)c1ccc(cc1)OC(Cl)(F)F)[N+](=O)[O-]

STK760865
Synonyms: 2-methyl-6-nitro-4-phenoxy-1,2-benzothiazol-3(2H)-one
Smiles: [O-][N+](=O)c1cc(Oc2ccccc2)c2c(c1)sn(c2=O)C

STK760871
Synonyms: 2-(benzylsulfonyl)-4,6-dinitrobenzonitrile
Smiles: N#Cc1c(cc(cc1S(=O)(=O)Cc1ccccc1)[N+](=O)[O-])[N+](=O)[O-]

STK760875
Synonyms: ethylbeta-[(9H-fluoren-9-ylacetyl)oxy]-N-formylphenylalaninate
Smiles: O=CNC(C(c1ccccc1)OC(=O)CC1c2ccccc2c2c1cccc2)C(=O)OCC

STK760876
Synonyms: 4,6-dinitro-1H-indole
Smiles: [O-][N+](=O)c1cc2[nH]ccc2c(c1)[N+](=O)[O-]

STK760877
Synonyms: {[(7E)-[1,2,5]oxadiazolo[3,4-d]pyrimidin-7(6H)-ylideneamino]oxy}(phenyl)methanone
Smiles: O=C(c1ccccc1)O/N=c\1/[nH]cnc2c1non2

STK675647
Synonyms: 5-(4-methoxyphenyl)-1-phenyl-3-(phenylamino)-4-(phenylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(cc1)C1C(=C(C(=O)N1c1ccccc1)Nc1ccccc1)C(=O)c1ccccc1

STK675652
Synonyms: (8Z)-8-{2-[4-(diethylamino)phenyl]hydrazinylidene}-4-methyl-2H-furo[2,3-h]chromene-2,9(8H)-dione
Smiles: CCN(c1ccc(cc1)N/N=C/1\Oc2c(C1=O)c1oc(=O)cc(c1cc2)C)CC

STK675654
Synonyms: 4-(dibutylphosphoryl)benzoicacid
Smiles: CCCCP(=O)(c1ccc(cc1)C(=O)O)CCCC

STK760885
Synonyms: (1,3-dioxo-2,3-dihydro-1H-inden-2-yl)(2-methyl-1H-indol-3-yl)propanedinitrile
Smiles: N#CC(c1c(C)[nH]c2c1cccc2)(C1C(=O)c2c(C1=O)cccc2)C#N

STK760886
Synonyms: (2Z)-2-{[1-(2-fluorobenzyl)-1H-indol-3-yl]methylidene}-1-benzothiophen-3(2H)-one
Smiles: Fc1ccccc1Cn1cc(c2c1cccc2)/C=C/1\Sc2c(C1=O)cccc2

STK760887
Synonyms: [4-(1,3-benzothiazol-2-yl)piperazin-1-yl](4-bromophenyl)methanone
Smiles: Brc1ccc(cc1)C(=O)N1CCN(CC1)c1nc2c(s1)cccc2

STK760892
Synonyms: 2,6-di-tert-butyl-4-[2-(2-hydroxyphenyl)-5,6-dimethoxy-1H-benzimidazol-1-yl]phenol
Smiles: COc1cc2c(cc1OC)nc(n2c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)c1ccccc1O

STK675660
Synonyms: benzyl1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indole-2-carboxylate
Smiles: O=C(N1CCc2c(C1)c1ccccc1[nH]2)OCc1ccccc1

STK760897
Synonyms: 2-(5,7-di-tert-butyl-2,3-dihydro-1,3-benzoxazol-2-yl)phenol
Smiles: Oc1ccccc1C1Nc2c(O1)c(cc(c2)C(C)(C)C)C(C)(C)C

STK760898
Synonyms: 1-(5,7-di-tert-butyl-2,3-dihydro-1,3-benzoxazol-2-yl)naphthalen-2-ol
Smiles: Oc1ccc2c(c1C1Nc3c(O1)c(cc(c3)C(C)(C)C)C(C)(C)C)cccc2

STK760899
Synonyms: N-(4-iodophenyl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
Smiles: O=C(c1n(C)ncc1[N+](=O)[O-])Nc1ccc(cc1)I

STK760900
Synonyms: 1-methyl-N,N'-bis(2-methylphenyl)-1H-pyrazole-3,5-dicarboxamide
Smiles: O=C(c1nn(c(c1)C(=O)Nc1ccccc1C)C)Nc1ccccc1C

STK675667
Synonyms: N-(quinolin-3-yl)-4-[(2,4,6-trimethylphenyl)carbonyl]benzamide
Smiles: Cc1cc(C)c(c(c1)C)C(=O)c1ccc(cc1)C(=O)Nc1cnc2c(c1)cccc2

STK760905
Synonyms: 1-(4-propoxyphenyl)-3-(2-thioxoimidazolidin-1-yl)pyrrolidine-2,5-dione
Smiles: CCCOc1ccc(cc1)N1C(=O)CC(C1=O)N1CCNC1=S

STK675672
Synonyms: 1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-ylN-(1,3-benzodioxol-5-ylmethyl)-N'-(4-ethoxyphenyl)carbamimidothioate
Smiles: CCOc1ccc(cc1)/N=C(\SC1CC(=O)N(C1=O)c1ccc(cc1)OCC)/NCc1ccc2c(c1)OCO2

STK760907
Synonyms: 3-(2-chloro-6-fluorophenyl)-N-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)-5-methyl-1,2-oxazole-4-carboxamide
Smiles: O=C(c1c(C)onc1c1c(F)cccc1Cl)NCC1COc2c(O1)cccc2

STK760913
Synonyms: 1-(3-methoxyphenyl)-5,5-bis[2-(pyridin-4-yl)ethyl]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: COc1cccc(c1)N1C(=O)NC(=O)C(C1=O)(CCc1ccncc1)CCc1ccncc1

STK675677
Synonyms: ethyl[1-(4-methoxyphenyl)-3-oxo-3-phenyl-2-(phenylcarbonyl)propyl]carbamate
Smiles: CCOC(=O)NC(C(C(=O)c1ccccc1)C(=O)c1ccccc1)c1ccc(cc1)OC

STK760914
Synonyms: 2-(ethylsulfanyl)-1-(2-fluorobenzyl)-1H-benzimidazole
Smiles: CCSc1nc2c(n1Cc1ccccc1F)cccc2

STK760915
Synonyms: 5-{2-[(4-bromophenyl)sulfanyl]ethyl}-1,3,4-thiadiazol-2-amine
Smiles: Brc1ccc(cc1)SCCc1nnc(s1)N

STK760925
Synonyms: 3-bromo-N'-[(E)-(8-hydroxyquinolin-5-yl)methylidene]benzohydrazide
Smiles: Brc1cccc(c1)C(=O)N/N=C/c1ccc(c2c1cccn2)O

STK760926
Synonyms: 4-(3-benzyl-4-oxo-1,3-thiazolidin-2-yl)-N-[2-(4-ethylphenoxy)ethyl]benzamide
Smiles: CCc1ccc(cc1)OCCNC(=O)c1ccc(cc1)C1SCC(=O)N1Cc1ccccc1

STK760933
Synonyms: 5,6-dimethyl-3-phenylthieno[2,3-d]pyrimidine-2,4(1H,3H)-dione
Smiles: O=c1[nH]c2sc(c(c2c(=O)n1c1ccccc1)C)C

STK760934
Synonyms: N-(4-ethoxyphenyl)-2-[2-(ethylsulfanyl)-1H-benzimidazol-1-yl]acetamide
Smiles: CCOc1ccc(cc1)NC(=O)Cn1c(SCC)nc2c1cccc2

STK675682
Synonyms: 4-{5-[(4-methoxybenzyl)sulfanyl]-1H-tetrazol-1-yl}benzoicacid
Smiles: COc1ccc(cc1)CSc1nnnn1c1ccc(cc1)C(=O)O

STK675683
Synonyms: 2-({4,6-dihydroxy-5-[3-(trimethylsilyl)propyl]pyrimidin-2-yl}sulfanyl)-1-phenylethanone
Smiles: O=C(c1ccccc1)CSc1nc(O)c(c(n1)O)CCC[Si](C)(C)C

STK760944
Synonyms: 4,4'-(1,3-benzodioxol-5-ylmethanediyl)bis(5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one)
Smiles: CC1=NN(C(=O)C1C(C1C(=NN(C1=O)c1ccccc1)C)c1ccc2c(c1)OCO2)c1ccccc1

STK675700
Synonyms: ethyl1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[4-(pyridin-2-yl)piperazin-1-yl]methyl}-1H-1,2,3-triazole-4-carboxylate
Smiles: CCOC(=O)c1nnn(c1CN1CCN(CC1)c1ccccn1)c1nonc1N

STK675703
Synonyms: 7-bromo-5-(morpholin-4-ylmethyl)quinolin-8-ol
Smiles: Brc1cc(CN2CCOCC2)c2c(c1O)nccc2

STK760959
Synonyms: N-(3'-acetyl-2,3-dihydro-3'H-spiro[benzo[f]thiochromene-1,2'-[1,3,4]thiadiazol]-5'-yl)acetamide
Smiles: CC(=O)NC1=NN(C2(S1)CCSc1c2c2ccccc2cc1)C(=O)C

STK675709
Synonyms: methyl2,6-bis(5,6-dibromo-1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl)hexanoate
Smiles: COC(=O)C(N1C(=O)C2C(C1=O)C1CC2C(C1Br)Br)CCCCN1C(=O)C2C(C1=O)C1CC2C(C1Br)Br

STK760964
Synonyms: 4-bromo-N-(1-methoxy-2,6-dimethyl-4-oxocyclohexa-2,5-dien-1-yl)benzenesulfonamide
Smiles: COC1(NS(=O)(=O)c2ccc(cc2)Br)C(=CC(=O)C=C1C)C

STK760970
Synonyms: 2-{[5-(2-hydroxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-1-phenylethanone
Smiles: O=C(c1ccccc1)CSc1nnc(o1)c1ccccc1O

STK675715
Synonyms: 1,1,10,10-tetraphenyl-4,7-dioxa-1,10-diphosphadecane1,10-dioxide
Smiles: O=P(c1ccccc1)(c1ccccc1)CCOCCOCCP(=O)(c1ccccc1)c1ccccc1

STK760977
Synonyms: 2-[2-nitro-4-(trifluoromethyl)phenoxy]-N-[3-(trifluoromethyl)phenyl]acetamide
Smiles: O=C(Nc1cccc(c1)C(F)(F)F)COc1ccc(cc1[N+](=O)[O-])C(F)(F)F

STK675725
Synonyms: 1,3,3-trimethyl-4-phenylpiperidin-4-ylacetate
Smiles: CN1CCC(C(C1)(C)C)(OC(=O)C)c1ccccc1

STK675726
Synonyms: 3-ethyl-1-methyl-4-phenylpiperidin-4-ylbenzoate
Smiles: CCC1CN(C)CCC1(OC(=O)c1ccccc1)c1ccccc1

STK675727
Synonyms: 1,3,3-trimethyl-4-phenylpiperidin-4-ylbenzoate
Smiles: CN1CCC(C(C1)(C)C)(OC(=O)c1ccccc1)c1ccccc1

STK760986
Synonyms: methyl{[3-cyano-6-oxo-4-(thiophen-3-yl)-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetate
Smiles: COC(=O)CSC1=C(C#N)C(CC(=O)N1)c1cscc1

STK675735
Synonyms: 5-{[(4-chlorophenyl)sulfonyl]methyl}-1,3,4-oxadiazol-2-amine
Smiles: Clc1ccc(cc1)S(=O)(=O)Cc1nnc(o1)N

STK675736
Synonyms: 2,8-dibenzyl-2,8-diazaspiro[5.5]undecane
Smiles: c1ccc(cc1)CN1CCCC2(C1)CCCN(C2)Cc1ccccc1

STK760993
Synonyms: 1-methyl-3-nitro[1,2,4]triazolo[5,1-c][1,2,4]triazin-4(1H)-one
Smiles: [O-][N+](=O)c1nn(C)c2n(c1=O)ncn2

STK675738
Synonyms: 4,6-dinitro-1-(4-nitrophenyl)-1H-indazole
Smiles: [O-][N+](=O)c1ccc(cc1)n1ncc2c1cc(cc2[N+](=O)[O-])[N+](=O)[O-]

STK760994
Synonyms: 7-methyl-1,3-dinitroacridine
Smiles: Cc1ccc2c(c1)cc1c(n2)cc(cc1[N+](=O)[O-])[N+](=O)[O-]

STK760996
Synonyms: 1-(4-methylphenyl)-4,6-dinitro-1H-indazole
Smiles: Cc1ccc(cc1)n1ncc2c1cc(cc2[N+](=O)[O-])[N+](=O)[O-]

STK675740
Synonyms: 2-{[(Z)-2-nitroethenyl]amino}benzoicacid
Smiles: [O-][N+](=O)/C=C\Nc1ccccc1C(=O)O

STK761001
Synonyms: N-{(E)-[5-(4-chloro-3-nitrophenyl)furan-2-yl]methylidene}-4H-1,2,4-triazol-4-amine
Smiles: [O-][N+](=O)c1cc(ccc1Cl)c1ccc(o1)/C=N/n1cnnc1

STK761012
Synonyms: N'-2,1,3-benzoxadiazol-5-yl-N,N-dimethylimidoformamide
Smiles: CN(/C=N\c1ccc2c(c1)non2)C

STK761021
Synonyms: 4-bromo-N-[(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)carbonothioyl]benzamide
Smiles: Brc1ccc(cc1)C(=O)NC(=S)N1CC2CC(C1)c1n(C2)c(=O)ccc1

STK675754
Synonyms: 3-(2-oxo-2H-1,4-benzoxazin-3-yl)propanoicacid
Smiles: OC(=O)CCc1nc2ccccc2oc1=O

STK761028
Synonyms: methyl3,3,3-trifluoro-2-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-{[2-oxo-2-(phenylamino)ethyl]sulfanyl}propanoate
Smiles: COC(=O)C(C(F)(F)F)(c1c(C)[nH]n(c1=O)c1ccccc1)SCC(=O)Nc1ccccc1

STK761032
Synonyms: 4a,5,6,7,8,9,10,11,12,13,14,14a-dodecahydrocyclododeca[b][1,3]dithiolo[4,5-e][1,4]dithiine-2-thione
Smiles: S=c1sc2c(s1)SC1C(S2)CCCCCCCCCC1

STK761035
Synonyms: 1-[4-(4-fluorophenyl)-6-hydroxy-3,6-dimethyl-4,5,6,7-tetrahydro-2,1-benzoxazol-5-yl]ethanone
Smiles: CC(=O)C1C(c2ccc(cc2)F)c2c(C)onc2CC1(C)O

STK761038
Synonyms: 2-methoxy-4-[(4-methylpiperidin-1-yl)carbonothioyl]phenyl4-methoxybenzoate
Smiles: COc1cc(ccc1OC(=O)c1ccc(cc1)OC)C(=S)N1CCC(CC1)C

STK761042
Synonyms: N'-[(4-chloro-1-methyl-1H-pyrazol-3-yl)carbonyl]-3-(2-chlorophenyl)-5-methyl-1,2-oxazole-4-carbohydrazide
Smiles: Cn1cc(c(n1)C(=O)NNC(=O)c1c(C)onc1c1ccccc1Cl)Cl

STK761043
Synonyms: 1-(2-methoxyphenyl)-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine
Smiles: COc1ccccc1N1CCN(CC1)c1ccc(cc1[N+](=O)[O-])C(F)(F)F

STK675759
Synonyms: 7-bromo-1-hydroxy-3-oxo-8-phenyl-2-azabicyclo[2.2.2]octane-4,5,5-tricarbonitrile
Smiles: N#CC12C(=O)NC(C(C1c1ccccc1)Br)(CC2(C#N)C#N)O

STK761044
Synonyms: N-(2,1,3-benzothiadiazol-5-yl)thiophene-2-carboxamide
Smiles: O=C(c1cccs1)Nc1ccc2c(c1)nsn2

STK761048
Synonyms: (1Z)-1-(3-ethoxy-4-hydroxybenzylidene)-6-methylfuro[3,4-c]pyridine-3,4(1H,5H)-dione
Smiles: CCOc1cc(ccc1O)/C=C/1\OC(=O)c2c1cc(C)[nH]c2=O

STK675760
Synonyms: 2'-bromo-6',6'-dimethyl-2-phenyl-2'-(prop-2-en-1-ylsulfanyl)-2,2',3,3',5',6'-hexahydro-1'H-spiro[chromene-4,4'-pyrimidin]-7-ol
Smiles: C=CCSC1(Br)NC(C)(C)CC2(N1)CC(Oc1c2ccc(c1)O)c1ccccc1

STK761066
Synonyms: 3-[(2Z)-2-[(4-ethoxyphenyl)imino]-4-(4-fluorophenyl)-1,3-thiazol-3(2H)-yl]propan-1-ol
Smiles: OCCCn1/c(=N/c2ccc(cc2)OCC)/scc1c1ccc(cc1)F

STK761070
Synonyms: 1-benzyl-2-(ethylsulfanyl)-1H-benzimidazole
Smiles: CCSc1nc2c(n1Cc1ccccc1)cccc2

STK761073
Synonyms: 5,7-dibromo-2-oxo-1,3-benzoxathiol-6-ylmethylcarbamate
Smiles: CNC(=O)Oc1c(Br)cc2c(c1Br)oc(=O)s2

STK761075
Synonyms: 5-chloro-2-oxo-1,3-benzoxathiol-6-ylphenylcarbamate
Smiles: O=C(Nc1ccccc1)Oc1cc2oc(=O)sc2cc1Cl

STK761080
Synonyms: 3-(3,7-diphenyl-4H-1,2-diazepin-5-yl)-1H-indole
Smiles: c1ccc(cc1)C1=NN=C(C=C(C1)c1c[nH]c2c1cccc2)c1ccccc1

STK761093
Synonyms: (8Z)-8-(4-bromobenzylidene)-4-methyl-2H-furo[2,3-h]chromene-2,9(8H)-dione
Smiles: Brc1ccc(cc1)/C=C/1\Oc2c(C1=O)c1oc(=O)cc(c1cc2)C

STK675770
Synonyms: 5-nitropyrimidine-2,4,6-triamine1,3-dioxide
Smiles: [O-][N+](=O)c1c(N)[n+]([O-])c([n+](c1N)[O-])N

STK761094
Synonyms: 3-amino-6-(methoxymethyl)-4-methylthieno[2,3-b]pyridine-2-carbonitrile
Smiles: COCc1cc(C)c2c(n1)sc(c2N)C#N

STK761100
Synonyms: 2-(hydroxymethyl)-2-(pyridin-2-yl)propane-1,3-diol
Smiles: OCC(c1ccccn1)(CO)CO

STK761103
Synonyms: 4-chloro-N-{4-[(diaminomethylidene)sulfamoyl]phenyl}benzamide
Smiles: Clc1ccc(cc1)C(=O)Nc1ccc(cc1)S(=O)(=O)N=C(N)N

STK761107
Synonyms: 1-(phenylsulfonyl)decahydroquinolin-4-ol
Smiles: OC1CCN(C2C1CCCC2)S(=O)(=O)c1ccccc1

STK761109
Synonyms: 3-(1,3-diphenyl-1H-pyrazol-5-yl)-1-methyl-1H-indole
Smiles: Cn1cc(c2c1cccc2)c1cc(nn1c1ccccc1)c1ccccc1

STK675784
Synonyms: 5-formyl-2,4-dimethyl-1H-pyrrole-3-carbonitrile
Smiles: O=Cc1[nH]c(c(c1C)C#N)C

STK675786
Synonyms: 2-(bicyclo[2.2.1]hept-5-en-2-yl)-1-[3-(morpholin-4-yl)-5-nitro-1-benzofuran-2-yl]propan-2-ol
Smiles: [O-][N+](=O)c1ccc2c(c1)c(N1CCOCC1)c(o2)CC(C1CC2CC1C=C2)(O)C

STK761112
Synonyms: 5-(4-chlorophenyl)-3-hydroxy-4-[(4-methylphenyl)carbonyl]-1-(pyridin-2-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Cc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccc(cc1)Cl)c1ccccn1

STK761118
Synonyms: 4-amino-N'-{[(4-chlorophenyl)carbonyl]oxy}-1,2,5-oxadiazole-3-carboximidamide
Smiles: Clc1ccc(cc1)C(=O)O/N=C(/c1nonc1N)\N

STK761122
Synonyms: (3Z)-1-[(2,6-dimethylmorpholin-4-yl)methyl]-3-(naphthalen-2-ylimino)-1,3-dihydro-2H-indol-2-one
Smiles: CC1OC(C)CN(C1)CN1c2ccccc2/C(=N/c2ccc3c(c2)cccc3)/C1=O

STK761128
Synonyms: 8-methyl-2-(4-methylphenyl)-1,2,4-triazaspiro[4.5]decane-3-thione
Smiles: CC1CCC2(CC1)NC(=S)N(N2)c1ccc(cc1)C

STK761131
Synonyms: 2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-(2-{[2-oxo-2-(phenylamino)ethyl]sulfanyl}-1,3-benzothiazol-6-yl)acetamide
Smiles: O=C(Nc1ccc2c(c1)sc(n2)SCC(=O)Nc1ccccc1)CSc1nnc(s1)N

STK761136
Synonyms: 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-N-[4-(trifluoromethoxy)phenyl]acetamide
Smiles: O=C(Nc1ccc(cc1)OC(F)(F)F)CSC1=NCCS1

STK675813
Synonyms: 2-oxo-2-{[4-(trifluoromethoxy)phenyl]amino}ethyl(2Z)-3-(furan-2-yl)prop-2-enoate
Smiles: O=C(Nc1ccc(cc1)OC(F)(F)F)COC(=O)/C=C\c1ccco1

STK761145
Synonyms: 3-methyl-N'-[(2E)-1-(5-methyl-3-nitro-1H-pyrazol-1-yl)propan-2-ylidene]benzohydrazide
Smiles: Cc1cccc(c1)C(=O)N/N=C(/Cn1nc(cc1C)[N+](=O)[O-])\C

STK675818
Synonyms: methyl1-[(E)-(2'-hydroxy-1,1':3',1''-terphenyl-5'-yl)diazenyl]-2-oxocyclopentanecarboxylate
Smiles: COC(=O)C1(CCCC1=O)/N=N/c1cc(c2ccccc2)c(c(c1)c1ccccc1)O

STK761162
Synonyms: 1-(2,6-dimethylmorpholin-4-yl)-2-(4-nitro-1H-pyrazol-1-yl)ethanone
Smiles: CC1OC(C)CN(C1)C(=O)Cn1ncc(c1)[N+](=O)[O-]

STK675820
Synonyms: 3-{[4-(ethoxycarbonyl)-4-phenylpiperidin-1-yl]methyl}benzoicacid
Smiles: CCOC(=O)C1(CCN(CC1)Cc1cccc(c1)C(=O)O)c1ccccc1

STK761171
Synonyms: N-[5-(1H-benzimidazol-2-yl)-1,3-thiazol-2-yl]formamide
Smiles: O=CNc1ncc(s1)c1nc2c([nH]1)cccc2

STK675822
Synonyms: 1,3,4,6-tetramethyl-2,5-dioxabicyclo[2.2.2]octane-3,6-diol(non-preferredname)
Smiles: CC12CCC(C(O1)(C)O)(OC2(C)O)C

STK761178
Synonyms: 2-[(2-cyclopropyl-2-oxoethyl)sulfanyl]-4-(4-methoxyphenyl)-6-phenylpyridine-3-carbonitrile
Smiles: N#Cc1c(SCC(=O)C2CC2)nc(cc1c1ccc(cc1)OC)c1ccccc1

STK675853
Synonyms: 1-[4-(3-fluorophenyl)-6-hydroxy-3,6-dimethyl-4,5,6,7-tetrahydro-2,1-benzoxazol-5-yl]ethanone
Smiles: CC(=O)C1C(c2cccc(c2)F)c2c(C)onc2CC1(C)O

STK761196
Synonyms: 5-(4-fluorophenyl)-3-hydroxy-4-[(4-methoxyphenyl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(cc1)C(=O)C1=C(O)C(=O)NC1c1ccc(cc1)F

STK761205
Synonyms: (2E)-3-phenyl-2-[(2E)-(pyridin-3-ylmethylidene)hydrazinylidene]-1,3-thiazolidin-4-one
Smiles: O=C1CS/C(=N/N=C/c2cccnc2)/N1c1ccccc1

STK761206
Synonyms: 2,3,4-trimethoxy-6,8-dioxabicyclo[3.2.1]octane(non-preferredname)
Smiles: COC1C(OC)C2OCC(C1OC)O2

STK761207
Synonyms: 2,3,4-tris(benzyloxy)-6,8-dioxabicyclo[3.2.1]octane(non-preferredname)
Smiles: c1ccc(cc1)COC1C(OCc2ccccc2)C2OCC(C1OCc1ccccc1)O2

STK761208
Synonyms: (1R,2R,4R,6R)-3,7,9-trioxatricyclo[4.2.1.0~2,4~]non-5-yl4-methylbenzenesulfonate(non-preferredname)
Smiles: Cc1ccc(cc1)S(=O)(=O)OC1[C@@H]2OC[C@@H](O2)[C@H]2[C@@H]1O2

STK675857
Synonyms: (1R,2R,4R,5R,6R)-5-(benzyloxy)-3,8,9-trioxatricyclo[4.2.1.0~2,4~]nonane(non-preferredname)
Smiles: c1ccc(cc1)CO[C@@H]1[C@H]2CO[C@H](O2)[C@@H]2[C@H]1O2

STK761212
Synonyms: N-(4-amino-2,5-diethoxyphenyl)benzamide
Smiles: CCOc1cc(N)c(cc1NC(=O)c1ccccc1)OCC

STK675861
Synonyms: 7,7,9,9-tetramethyl-4-methylidene-1,3-dioxa-8-azaspiro[4.5]decan-2-one
Smiles: C=C1OC(=O)OC21CC(C)(C)NC(C2)(C)C

STK761214
Synonyms: benzo[1,2-c:3,4-c':5,6-c'']tris[1,2,5]oxadiazole1,4,9-trioxide
Smiles: [O-][n+]1onc2c1c1no[n+](c1c1c2no[n+]1[O-])[O-]

STK675866
Synonyms: 4-(morpholin-4-yl)-1,2,5-thiadiazol-3-ol
Smiles: Oc1nsnc1N1CCOCC1

STK761215
Synonyms: 4-methyl-5-methylidene-4-[2-(2,6,6-trimethylcyclohex-1-en-1-yl)ethyl]-1,3-dioxolan-2-one
Smiles: O=C1OC(=C)C(O1)(C)CCC1=C(C)CCCC1(C)C

STK761217
Synonyms: 2-amino-7-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Smiles: Cc1cc(=O)n2c(n1)sc(n2)N

STK761219
Synonyms: ethyl[({(Z)-[(4,6-dimethylpyrimidin-2-yl)amino][(1H-1,2,4-triazol-5-ylsulfonyl)amino]methylidene}amino)oxy]acetate
Smiles: CCOC(=O)CO/N=C(\NS(=O)(=O)c1ncn[nH]1)/Nc1nc(C)cc(n1)C

STK761222
Synonyms: 2,6-dichloro-N-(4-methoxyphenyl)-4-methylpyridine-3-carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1c(C)cc(nc1Cl)Cl

STK761229
Synonyms: 1-(2-chlorophenyl)-3-(4-methylpyridin-2-yl)urea
Smiles: O=C(Nc1ccccc1Cl)Nc1nccc(c1)C

STK761233
Synonyms: 1-(2-chlorophenyl)-3-quinolin-8-ylurea
Smiles: O=C(Nc1cccc2c1nccc2)Nc1ccccc1Cl

STK761234
Synonyms: 2,6-dichloro-4-methylpyridine-3-carbonitrile
Smiles: N#Cc1c(C)cc(nc1Cl)Cl

STK675876
Synonyms: 2,6-dichloro-N-[(4-chlorophenyl)carbamoyl]-4-methyl-5-nitropyridine-3-carboxamide
Smiles: O=C(NC(=O)c1c(Cl)nc(c(c1C)[N+](=O)[O-])Cl)Nc1ccc(cc1)Cl

STK761236
Synonyms: N-(butylcarbamoyl)-2,6-dichloro-4-methyl-5-nitropyridine-3-carboxamide
Smiles: CCCCNC(=O)NC(=O)c1c(Cl)nc(c(c1C)[N+](=O)[O-])Cl

STK675877
Synonyms: ethyl5-chloro-4-hydroxy-6-methyl-2-oxo-1,2-dihydropyridine-3-carboxylate
Smiles: CCOC(=O)c1c(=O)[nH]c(c(c1O)Cl)C

STK761240
Synonyms: N-(butylcarbamoyl)-2-chloro-4,6-dimethylpyridine-3-sulfonamide
Smiles: CCCCNC(=O)NS(=O)(=O)c1c(C)cc(nc1Cl)C

STK675881
Synonyms: 1-(3-chlorophenyl)-3-(4,6-dimethyl-1H-pyrazolo[3,4-b]pyridin-3-yl)urea
Smiles: O=C(Nc1n[nH]c2c1c(C)cc(n2)C)Nc1cccc(c1)Cl

STK761241
Synonyms: 2,6-dichloro-N-(4-chlorophenyl)-4-methylpyridine-3-carboxamide
Smiles: Clc1ccc(cc1)NC(=O)c1c(C)cc(nc1Cl)Cl

STK761244
Synonyms: N-benzyl-N-methyl-1H-1,2,4-triazole-5-sulfonamide
Smiles: CN(S(=O)(=O)c1ncn[nH]1)Cc1ccccc1

STK675882
Synonyms: 1-benzyl-N-(cyclohexylcarbamoyl)-1H-1,2,4-triazole-3-sulfonamide
Smiles: O=C(NS(=O)(=O)c1ncn(n1)Cc1ccccc1)NC1CCCCC1

STK761245
Synonyms: N~2~-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfonyl]-3-methylisovalinamide
Smiles: Cc1cc(C)n2c(n1)nc(n2)S(=O)(=O)NC(C(=O)N)(C(C)C)C

STK675884
Synonyms: (1E)-1-(1,3-benzodioxol-5-ylmethylidene)-6-methylfuro[3,4-c]pyridine-3,4(1H,3aH)-dione
Smiles: O=C1O/C(=C/c2ccc3c(c2)OCO3)/C2=CC(=NC(=O)C12)C

STK675887
Synonyms: 5-[(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)methyl]-4-ethyl-3-methyl-1H-pyrrole-2-carboxylicacid
Smiles: CCc1c(Cc2[nH]c(c(c2C)C(=O)C)C)[nH]c(c1C)C(=O)O

STK675889
Synonyms: 2,6-dichloro-4-methyl-5-nitro-N-{[2-(trifluoromethyl)phenyl]carbamoyl}pyridine-3-carboxamide
Smiles: O=C(NC(=O)c1c(Cl)nc(c(c1C)[N+](=O)[O-])Cl)Nc1ccccc1C(F)(F)F

STK675890
Synonyms: 2-chloro-N-(2,4,5-trichlorophenyl)benzenesulfonamide
Smiles: Clc1cc(Cl)c(cc1NS(=O)(=O)c1ccccc1Cl)Cl

STK675891
Synonyms: 2,4,5-trichlorobenzenesulfonamide
Smiles: Clc1cc(c(cc1Cl)Cl)S(=O)(=O)N

STK675892
Synonyms: 5,7-dimethyl-N-(prop-2-en-1-yl)[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide
Smiles: C=CCNS(=O)(=O)c1nn2c(n1)nc(cc2C)C

STK675893
Synonyms: N-(3-fluorophenyl)-5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidine-2-sulfonamide
Smiles: Fc1cccc(c1)NS(=O)(=O)c1nn2c(n1)nc(cc2C)C

STK761253
Synonyms: 1-chloro-4-[(1Z)-3-hydroxy-3-phenyltriaz-1-en-1-yl]anthracene-9,10-dione
Smiles: ON(c1ccccc1)/N=N\c1ccc(c2c1C(=O)c1ccccc1C2=O)Cl

STK761259
Synonyms: 5,7-dibromo-2-oxo-1,3-benzoxathiol-6-ylbutylcarbamate
Smiles: CCCCNC(=O)Oc1c(Br)cc2c(c1Br)oc(=O)s2

STK761269
Synonyms: 2,7-dioxo-2,7-dihydro-3H-naphtho[1,2,3-de]quinoline-1-carbonitrile
Smiles: N#Cc1c(=O)[nH]c2c3c1c1ccccc1c(=O)c3ccc2

STK761272
Synonyms: 4-[(3-methyl-2,7-dioxo-2,7-dihydro-3H-naphtho[1,2,3-de]quinolin-6-yl)amino]benzaldehyde
Smiles: O=Cc1ccc(cc1)Nc1ccc2c3c1c(=O)c1ccccc1c3cc(=O)n2C

STK675903
Synonyms: ethyl6-methyl-2-({[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nncn2C)sc2c1CCC(C2)C

STK761279
Synonyms: 2-(dimethylamino)ethyl5-methoxy-1,2-dimethyl-1H-indole-3-carboxylate
Smiles: COc1ccc2c(c1)c(C(=O)OCCN(C)C)c(n2C)C

STK761282
Synonyms: 1-hydroxy-N-(4-methoxyphenyl)-9,10-dioxo-9,10-dihydroanthracene-2-carboxamide
Smiles: COc1ccc(cc1)NC(=O)c1ccc2c(c1O)C(=O)c1c(C2=O)cccc1

STK761283
Synonyms: 4-acetyl-3-hydroxy-1-(4-hydroxyphenyl)-5-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(cc1)C1N(c2ccc(cc2)O)C(=O)C(=C1C(=O)C)O

STK675905
Synonyms: 4-{3-hydroxy-4-[(4-methylphenyl)carbonyl]-2-oxo-5-phenyl-2,5-dihydro-1H-pyrrol-1-yl}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: Cc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1ccccc1)c1c(C)n(n(c1=O)c1ccccc1)C

STK761286
Synonyms: 6-chloro-2-(3-fluorophenyl)-4H-chromen-4-one
Smiles: Clc1ccc2c(c1)c(=O)cc(o2)c1cccc(c1)F

STK761287
Synonyms: 2-(3-fluorophenyl)-6-methyl-4H-chromen-4-one
Smiles: Cc1ccc2c(c1)c(=O)cc(o2)c1cccc(c1)F

STK675915
Synonyms: 7-chloro-5-{[4-(2-methoxyphenyl)piperazin-1-yl]methyl}quinolin-8-ol
Smiles: COc1ccccc1N1CCN(CC1)Cc1cc(Cl)c(c2c1cccn2)O

STK675918
Synonyms: N-[2-({2-[(3-chloro-4-methylphenyl)amino]-2-oxoethyl}sulfanyl)-1,3-benzothiazol-6-yl]-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
Smiles: O=C(Nc1ccc2c(c1)sc(n2)SCC(=O)Nc1ccc(c(c1)Cl)C)CSc1nnc(s1)C

STK675920
Synonyms: ethyl2-amino-5-oxo-4-phenyl-1-(4-sulfamoylphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCOC(=O)C1=C(N)N(C2=C(C1c1ccccc1)C(=O)CCC2)c1ccc(cc1)S(=O)(=O)N

STK675925
Synonyms: 2-ethoxy-4-[(4-methylpiperidin-1-yl)carbonothioyl]phenyl4-nitrobenzenesulfonate
Smiles: CCOc1cc(ccc1OS(=O)(=O)c1ccc(cc1)[N+](=O)[O-])C(=S)N1CCC(CC1)C

STK675927
Synonyms: 2,3,3,3-tetrafluoro-2-(heptafluoropropoxy)-N-(6-methylpyridin-2-yl)propanamide
Smiles: O=C(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)Nc1cccc(n1)C

STK675930
Synonyms: (1E)-1-[3-iodo-5-methoxy-4-(prop-2-yn-1-yloxy)benzylidene]-2-[2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenyl]hydrazine
Smiles: C#CCOc1c(I)cc(cc1OC)/C=N/Nc1c(F)c(F)c(c(c1F)F)C(F)(F)F

STK761341
Synonyms: [4-methyl-6-(thiophen-2-yl)-1,5,2-dioxazinan-2-yl](phenyl)methanone
Smiles: CC1CN(OC(O1)c1cccs1)C(=O)c1ccccc1

STK675933
Synonyms: 4-{2-(4-chlorophenyl)-3-[(4-chlorophenyl)carbonyl]-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl}-N-(1,3-thiazol-2-yl)benzenesulfonamide
Smiles: Clc1ccc(cc1)C1N(c2ccc(cc2)S(=O)(=O)Nc2nccs2)C(=O)C(=C1C(=O)c1ccc(cc1)Cl)O

STK675937
Synonyms: ethyl(4-oxo-1,3,4,6,7,11b-hexahydro-2H-pyrazino[2,1-a]isoquinolin-3-yl)acetate
Smiles: CCOC(=O)CC1NCC2N(C1=O)CCc1c2cccc1

STK675945
Synonyms: 7-chloro-5-(morpholin-4-ylmethyl)quinolin-8-ol
Smiles: Clc1cc(CN2CCOCC2)c2c(c1O)nccc2

STK761364
Synonyms: quinolin-8-yl3-(azepan-1-ylsulfonyl)benzoate
Smiles: O=C(c1cccc(c1)S(=O)(=O)N1CCCCCC1)Oc1cccc2c1nccc2

STK761365
Synonyms: N'-[(E)-(7-methoxy-2-oxo-1,3-benzoxathiol-5-yl)methylidene]pyridine-3-carbohydrazide
Smiles: COc1cc(/C=N/NC(=O)c2cccnc2)cc2c1oc(=O)s2

STK675949
Synonyms: 6-bromo-N-(2-phenoxyethyl)-2-phenylquinoline-4-carboxamide
Smiles: Brc1ccc2c(c1)c(cc(n2)c1ccccc1)C(=O)NCCOc1ccccc1

STK761373
Synonyms: N-[2,2,2-trichloro-1-(2-methyl-1H-indol-3-yl)ethyl]benzenesulfonamide
Smiles: Cc1[nH]c2c(c1C(C(Cl)(Cl)Cl)NS(=O)(=O)c1ccccc1)cccc2

STK761374
Synonyms: N-[2,2,2-trichloro-1-(1H-indol-3-yl)ethyl]benzenesulfonamide
Smiles: ClC(C(c1c[nH]c2c1cccc2)NS(=O)(=O)c1ccccc1)(Cl)Cl

STK761376
Synonyms: 1-amino-6-bromo-4-methyl-3H-naphtho[1,2,3-de]quinoline-2,7-dione
Smiles: Cc1cc(Br)c2c3c1[nH]c(=O)c(c3c1c(c2=O)cccc1)N

STK761382
Synonyms: 6-amino-4-(3,4-dimethoxyphenyl)-3-methyl-1-(4-methylphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(c(c1)OC)OC)c(C)nn2c1ccc(cc1)C

STK761385
Synonyms: 6-amino-4-(2-fluorophenyl)-3-methyl-1-(4-methylphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1ccccc1F)c(C)nn2c1ccc(cc1)C

STK761396
Synonyms: 6-amino-4-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: N#CC1=C(N)Oc2c(C1c1c(C)nn(c1Cl)c1ccccc1)c(C)[nH]n2

STK675956
Synonyms: propan-2-yl5-cyano-2-methyl-6-sulfanyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxylate
Smiles: N#CC1=C(S)NC(=C(C1c1cccs1)C(=O)OC(C)C)C

STK761406
Synonyms: 6-amino-4-(2-ethoxy-4-hydroxyphenyl)-3-propyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: CCCc1n[nH]c2c1C(C(=C(O2)N)C#N)c1ccc(cc1OCC)O

STK761408
Synonyms: 6-amino-4-(3-ethoxy-4-hydroxyphenyl)-3-(methoxymethyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Smiles: COCc1n[nH]c2c1C(c1ccc(c(c1)OCC)O)C(=C(O2)N)C#N

STK675961
Synonyms: ethyl4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-oxobutanoate
Smiles: CCOC(=O)CC(=O)CN1C(=O)c2c(C1=O)cccc2

STK761419
Synonyms: N-[(2Z,5Z)-5-(1-acetyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-4-oxo-1,3-thiazolidin-2-ylidene]acetamide
Smiles: CC(=O)/N=C\1/NC(=O)/C(=C\2/C(=O)N(c3c2cccc3)C(=O)C)/S1

STK761423
Synonyms: 5-chloro-3-({[3-(trifluoromethyl)phenyl]amino}methyl)-1,3-benzoxazole-2(3H)-thione
Smiles: Clc1ccc2c(c1)n(CNc1cccc(c1)C(F)(F)F)c(=S)o2

STK761446
Synonyms: 1-amino-4-methyl-3H-naphtho[1,2,3-de]quinoline-2,7-dione
Smiles: Cc1ccc2c3c1[nH]c(=O)c(c3c1c(c2=O)cccc1)N

STK761448
Synonyms: 1-(butylamino)-3H-naphtho[1,2,3-de]quinoline-2,7-dione
Smiles: CCCCNc1c(=O)[nH]c2c3c1c1ccccc1c(=O)c3ccc2

STK761451
Synonyms: 6-(2,5-dimethoxyphenyl)-3-methyl-5H-[1,2,4]triazolo[4,3-b][1,2,4]triazole
Smiles: COc1ccc(cc1c1[nH]n2c(n1)nnc2C)OC

STK761454
Synonyms: 2-[(2,5-dioxo-1-phenylpyrrolidin-3-yl)sulfanyl]-6-(thiophen-2-yl)-4-(trifluoromethyl)pyridine-3-carbonitrile
Smiles: N#Cc1c(SC2CC(=O)N(C2=O)c2ccccc2)nc(cc1C(F)(F)F)c1cccs1

STK675972
Synonyms: 3-(2-chloroethyl)-2-hydroxyquinazolin-4(3H)-one
Smiles: ClCCn1c(O)nc2c(c1=O)cccc2

STK675973
Synonyms: 5-[(2-methyl-4-nitro-1H-imidazol-1-yl)methyl]-1,3,4-thiadiazol-2-amine
Smiles: Nc1nnc(s1)Cn1cc(nc1C)[N+](=O)[O-]

STK761462
Synonyms: 1-{2-[(1,3-dimethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-4-nitrophenyl}piperidine-4-carboxamide
Smiles: NC(=O)C1CCN(CC1)c1ccc(cc1C=C1C(=O)N(C)C(=O)N(C1=O)C)[N+](=O)[O-]

STK761463
Synonyms: N'-[(4Z,5E)-5-(hydroxyimino)-6,7-dihydro-2,1,3-benzoxadiazol-4(5H)-ylidene]benzohydrazide
Smiles: O/N=C/1\CCc2c(\C1=N\NC(=O)c1ccccc1)non2

STK761467
Synonyms: 2-(benzylsulfanyl)-4,6-dinitrobenzamide
Smiles: [O-][N+](=O)c1cc(SCc2ccccc2)c(c(c1)[N+](=O)[O-])C(=O)N

STK675975
Synonyms: 4-azido-6-nitro-2-phenyl-1,2-benzothiazol-3(2H)-one
Smiles: [N-]=[N+]=Nc1cc(cc2c1c(=O)n(s2)c1ccccc1)[N+](=O)[O-]

STK761469
Synonyms: trimethyl2,2',2''-[(2-cyanobenzene-1,3,5-triyl)trisulfanediyl]triacetate
Smiles: COC(=O)CSc1cc(SCC(=O)OC)c(c(c1)SCC(=O)OC)C#N

STK675976
Synonyms: 2-(benzylsulfanyl)-4,6-dimethoxybenzonitrile
Smiles: COc1cc(SCc2ccccc2)c(c(c1)OC)C#N

STK761470
Synonyms: methyl3-amino-4,6-dinitro-1-benzothiophene-2-carboxylate
Smiles: COC(=O)c1sc2c(c1N)c(cc(c2)[N+](=O)[O-])[N+](=O)[O-]

STK761473
Synonyms: 4-[(E)-{[1-(5-chloro-1H-indol-3-yl)propan-2-yl]imino}methyl]-N,N-dimethylaniline
Smiles: Clc1ccc2c(c1)c(c[nH]2)CC(/N=C/c1ccc(cc1)N(C)C)C

STK675980
Synonyms: propan-2-yl1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-1H-1,2,3-triazole-4-carboxylate
Smiles: CC(OC(=O)c1nnn(c1CN1CCN(CC1)c1ccc(cc1)F)c1nonc1N)C

STK761477
Synonyms: (8Z)-4-methyl-8-(2-phenylhydrazinylidene)-2H-furo[2,3-h]chromene-2,9(8H)-dione
Smiles: O=c1cc(C)c2c(o1)c1c(cc2)O/C(=N\Nc2ccccc2)/C1=O

STK761486
Synonyms: ethyl4-{(2E)-3-(1,3-benzodioxol-5-yl)-2-[(thiophen-2-ylcarbonyl)amino]prop-2-enoyl}piperazine-1-carboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=O)/C(=C\c1ccc2c(c1)OCO2)/NC(=O)c1cccs1

STK761487
Synonyms: 4-bromo-2-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)phenol
Smiles: Brc1ccc(c(c1)C1SCc2c(CS1)cc(c(c2)C)C)O

STK761490
Synonyms: 3-(4-chlorophenyl)-7,8-dimethyl-1,5-dihydro-2,4-benzodithiepine
Smiles: Clc1ccc(cc1)C1SCc2c(CS1)cc(c(c2)C)C

STK761491
Synonyms: 5-oxo-5-[(2,4,6-trichlorophenyl)amino]pentane-1,2,3,4-tetrayltetraacetate(non-preferredname)
Smiles: O=C(C(C(C(OC(=O)C)COC(=O)C)OC(=O)C)OC(=O)C)Nc1c(Cl)cc(cc1Cl)Cl

STK761503
Synonyms: 2-(7,8-dimethyl-1,5-dihydro-2,4-benzodithiepin-3-yl)-5-methylphenol
Smiles: Cc1ccc(c(c1)O)C1SCc2c(CS1)cc(c(c2)C)C

STK761508
Synonyms: 5-[(2,4-dimethylphenyl)amino]-5-oxopentane-1,2,3,4-tetrayltetraacetate(non-preferredname)
Smiles: CC(=O)OC(C(C(OC(=O)C)COC(=O)C)OC(=O)C)C(=O)Nc1ccc(cc1C)C

STK675982
Synonyms: ethyl4-(biphenyl-4-yl)-2-{[2,3,4,5-tetrakis(acetyloxy)pentanoyl]amino}thiophene-3-carboxylate(non-preferredname)
Smiles: CCOC(=O)c1c(scc1c1ccc(cc1)c1ccccc1)NC(=O)C(C(C(OC(=O)C)COC(=O)C)OC(=O)C)OC(=O)C

STK761515
Synonyms: 4-chloro-N-[2,2,2-trichloro-1-(2-methyl-1H-indol-3-yl)ethyl]benzenesulfonamide
Smiles: Clc1ccc(cc1)S(=O)(=O)NC(C(Cl)(Cl)Cl)c1c(C)[nH]c2c1cccc2

STK761520
Synonyms: 2-{[4-(morpholin-4-yl)-6-(propan-2-ylamino)-1,3,5-triazin-2-yl]amino}ethanol
Smiles: OCCNc1nc(NC(C)C)nc(n1)N1CCOCC1

STK761521
Synonyms: 1-[4-(4-chlorophenyl)-6-hydroxy-3,6-dimethyl-4,5,6,7-tetrahydro-2,1-benzoxazol-5-yl]ethanone
Smiles: CC(=O)C1C(c2ccc(cc2)Cl)c2c(C)onc2CC1(C)O

STK675989
Synonyms: 4-ethanimidoyl-3-hydroxy-1-methyl-5-phenyl-1,5-dihydro-2H-pyrrol-2-one
Smiles: CC(=N)C1=C(O)C(=O)N(C1c1ccccc1)C

STK675990
Synonyms: 1-methyl-4-phenylisoquinoline
Smiles: Cc1ncc(c2c1cccc2)c1ccccc1

STK675993
Synonyms: 6-(4-fluorophenyl)-5-phenyl-7-[3-(trifluoromethyl)phenyl]-2,3,6,7-tetrahydropyrrolo[3,4-e][1,4]diazepin-8(1H)-one
Smiles: Fc1ccc(cc1)C1N(c2cccc(c2)C(F)(F)F)C(=O)C2=C1C(=NCCN2)c1ccccc1

STK761536
Synonyms: 2-[(4-{[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}butanoyl)amino]-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
Smiles: O=C(Nc1sc2c(c1C(=O)N)CCCCCC2)CCCSc1nc(C)cc(n1)C(F)(F)F

STK675995
Synonyms: 1-(2-oxo-1-oxaspiro[4.5]dec-3-en-4-yl)piperidine-4-carboxamide
Smiles: NC(=O)C1CCN(CC1)C1=CC(=O)OC21CCCCC2

STK675998
Synonyms: 4-hydroxy-4,7,7,9,9-pentamethyl-3-(2,2,6,6-tetramethylpiperidin-4-yl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one
Smiles: O=C1OC2(C(N1C1CC(C)(C)NC(C1)(C)C)(C)O)CC(C)(C)NC(C2)(C)C

STK675999
Synonyms: dimethyl(3-methoxy-6-nitro-1,2-benzothiazol-4-yl)phosphoramidate
Smiles: COc1nsc2c1c(cc(c2)[N+](=O)[O-])NP(=O)(OC)OC

STK676001
Synonyms: 1,5-diethoxy-2,4-dinitrobenzene
Smiles: CCOc1cc(OCC)c(cc1[N+](=O)[O-])[N+](=O)[O-]

STK676002
Synonyms: 5-(dimethylamino)pyrimidine-2,4(1H,3H)-dione
Smiles: CN(c1c[nH]c(=O)[nH]c1=O)C

STK761542
Synonyms: 6-(difluoromethyl)-4-(2-methylpropyl)-5-[(methylsulfanyl)carbonyl]-2-(trifluoromethyl)pyridine-3-carbothioicS-acid
Smiles: CSC(=O)c1c(nc(c(c1CC(C)C)C(=O)S)C(F)(F)F)C(F)F

STK676003
Synonyms: 3-(decylsulfanyl)propanoicacid
Smiles: CCCCCCCCCCSCCC(=O)O

STK676005
Synonyms: 7-(butylsulfanyl)heptanoicacid
Smiles: CCCCSCCCCCCC(=O)O

STK761545
Synonyms: 4-methyl-N-[(5Z)-7-nitro-5H-indeno[1,2-b]pyridin-5-ylidene]aniline
Smiles: Cc1ccc(cc1)/N=C/1\c2cccnc2c2c1cc(cc2)[N+](=O)[O-]

STK676006
Synonyms: N,N,N',N'-tetraethyl-4-phenylpyridine-3,5-dicarboxamide
Smiles: CCN(C(=O)c1cncc(c1c1ccccc1)C(=O)N(CC)CC)CC

STK761548
Synonyms: methyl8-methyl-1,2-bis(propylsulfonyl)indolizine-3-carboxylate
Smiles: CCCS(=O)(=O)c1c2c(C)cccn2c(c1S(=O)(=O)CCC)C(=O)OC

STK761550
Synonyms: 2,6-dimethoxy-4-{5-phenyl-4-[4-(phenylsulfanyl)phenyl]-1H-imidazol-2-yl}phenol
Smiles: COc1cc(cc(c1O)OC)c1nc(c([nH]1)c1ccccc1)c1ccc(cc1)Sc1ccccc1

STK761552
Synonyms: 2-(4-chlorobenzyl)-2-(4-chlorophenyl)-1H-indene-1,3(2H)-dione
Smiles: Clc1ccc(cc1)CC1(c2ccc(cc2)Cl)C(=O)c2c(C1=O)cccc2

STK676013
Synonyms: 6-(3,5-dimethyl-1H-pyrazol-1-yl)-N-(2-methylphenyl)[1,2,5]oxadiazolo[3,4-b]pyrazin-5-amine
Smiles: Cc1cc(n(n1)c1nc2nonc2nc1Nc1ccccc1C)C

STK761561
Synonyms: (2Z)-2-{[5-(2-fluorophenyl)furan-2-yl]methylidene}-1-benzothiophen-3(2H)-one
Smiles: Fc1ccccc1c1ccc(o1)/C=C/1\Sc2c(C1=O)cccc2

STK761567
Synonyms: 2-(2-chlorophenyl)-7-hydroxy-6',6'-dimethyl-2,3,5',6'-tetrahydro-1'H-spiro[chromene-4,4'-pyrimidine]-2'(3'H)-thione
Smiles: S=C1NC(C)(C)CC2(N1)CC(Oc1c2ccc(c1)O)c1ccccc1Cl

STK761568
Synonyms: 6-chloro-2-(2-chlorophenyl)-7-hydroxy-6',6'-dimethyl-2,3,5',6'-tetrahydro-1'H-spiro[chromene-4,4'-pyrimidine]-2'(3'H)-thione
Smiles: S=C1NC(C)(C)CC2(N1)CC(Oc1c2cc(Cl)c(c1)O)c1ccccc1Cl

STK676024
Synonyms: 2-(2-imino-6-methoxy-1,3-benzothiazol-3(2H)-yl)ethanol
Smiles: OCCn1c(=N)sc2c1ccc(c2)OC

STK676025
Synonyms: 3-cyclopropylprop-2-ynoicacid
Smiles: OC(=O)C#CC1CC1

STK676027
Synonyms: ethylcarbamothioylhydrazonoformate
Smiles: CCO/C=N/NC(=S)N

STK761573
Synonyms: 3,4,5-triphenyl-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one
Smiles: O=C1N(c2ccccc2)C(c2c1n[nH]c2c1ccccc1)c1ccccc1

STK761574
Synonyms: spiro[1,3-benzoxazine-2,1'-cyclohexane]-4(3H)-thione
Smiles: S=C1NC2(CCCCC2)Oc2c1cccc2

STK676031
Synonyms: 3-(butylsulfanyl)-5-[(2-oxo-2-phenylethyl)sulfanyl]-1,2-thiazole-4-carbonitrile
Smiles: CCCCSc1nsc(c1C#N)SCC(=O)c1ccccc1

STK761581
Synonyms: (3Z,6E)-5-(2-fluorobenzyl)-2,8-dioxa-3,4,6,7-tetraazanona-3,6-diene4,6-dioxide
Smiles: CO/N=[N+](\C(/[N+](=N/OC)/[O-])Cc1ccccc1F)/[O-]

STK761586
Synonyms: 4,4'-(1,4,2,5-dioxadiazine-3,6-diyl)bis(1,2,5-oxadiazol-3-amine)
Smiles: Nc1nonc1C1=NOC(=NO1)c1nonc1N

STK761596
Synonyms: 2-[(2-bromobenzyl)sulfanyl]-4-oxo-3-azaspiro[5.5]undec-1-ene-1,5-dicarbonitrile
Smiles: N#CC1C(=O)NC(=C(C21CCCCC2)C#N)SCc1ccccc1Br

STK761599
Synonyms: 5,7-dichloroquinolin-8-ylnaphthalene-1-sulfonate
Smiles: Clc1cc(Cl)c2c(c1OS(=O)(=O)c1cccc3c1cccc3)nccc2

STK761603
Synonyms: 5,7-dichloroquinolin-8-yl4-butoxybenzenesulfonate
Smiles: CCCCOc1ccc(cc1)S(=O)(=O)Oc1c(Cl)cc(c2c1nccc2)Cl

STK761604
Synonyms: 5,7-dichloroquinolin-8-yl2,4-dimethylbenzenesulfonate
Smiles: Cc1ccc(c(c1)C)S(=O)(=O)Oc1c(Cl)cc(c2c1nccc2)Cl

STK761605
Synonyms: 5,7-dichloroquinolin-8-ylbenzenesulfonate
Smiles: Clc1cc(Cl)c2c(c1OS(=O)(=O)c1ccccc1)nccc2

STK761609
Synonyms: 5,7-dichloroquinolin-8-yl5-iodo-2-methylbenzenesulfonate
Smiles: Ic1ccc(c(c1)S(=O)(=O)Oc1c(Cl)cc(c2c1nccc2)Cl)C

STK761611
Synonyms: N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetamide
Smiles: CCn1c2ccccc2c2c1nc(SCC(=O)Nc1c(C)n(n(c1=O)c1ccccc1)C)nn2

STK676036
Synonyms: 2-[(8-bromo-5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)acetamide
Smiles: O=C(Nc1c(=O)n(n(c1C)C)c1ccccc1)CSc1nnc2c(n1)n(C)c1c2cc(cc1)Br

STK761617
Synonyms: 3-(4-bromophenyl)-4,4-dimethyl-2-oxaspiro[5.5]undecane-1,5-dione
Smiles: Brc1ccc(cc1)C1OC(=O)C2(C(=O)C1(C)C)CCCCC2

STK761618
Synonyms: 3-(4-methoxyphenyl)-4,4-dimethyl-2-oxaspiro[5.5]undecane-1,5-dione
Smiles: COc1ccc(cc1)C1OC(=O)C2(C(=O)C1(C)C)CCCCC2

STK676038
Synonyms: 7,8-dimethyl-4-(trifluoromethyl)-1,3-dihydro-2H-1,5-benzodiazepin-2-one
Smiles: O=C1CC(=Nc2c(N1)cc(C)c(c2)C)C(F)(F)F

STK761626
Synonyms: N-phenyl[1,2,5]oxadiazolo[3,4-e][1,2,4]triazolo[4,3-a]pyrazin-5-amine
Smiles: c1ccc(cc1)Nc1nc2nonc2n2c1nnc2

STK676040
Synonyms: (3Z)-3-(2-{6-[(4-methylphenyl)amino][1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl}hydrazinylidene)-1,3-dihydro-2H-indol-2-one
Smiles: Cc1ccc(cc1)Nc1nc2nonc2nc1N/N=C/1\C(=O)Nc2c1cccc2

STK761648
Synonyms: 4-nitro-1-(prop-1-en-2-yl)-1,3-dihydro-2H-benzimidazol-2-one
Smiles: [O-][N+](=O)c1cccc2c1[nH]c(=O)n2C(=C)C

STK676043
Synonyms: 4-hydroxy-3,4,5-trimethyl-5-[2-(2,6,6-trimethylcyclohex-1-en-1-yl)ethyl]-1,3-oxazolidin-2-one
Smiles: CC1=C(CCC2(C)OC(=O)N(C2(C)O)C)C(CCC1)(C)C

STK761653
Synonyms: 4-acetyl-5-(2-fluorophenyl)-1-(4-fluorophenyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one
Smiles: Fc1ccc(cc1)N1C(=O)C(=C(C1c1ccccc1F)C(=O)C)O

STK761660
Synonyms: 5,7-dichloroquinolin-8-yl2,4-dichloro-5-methylbenzenesulfonate
Smiles: Clc1cc(Cl)c(cc1C)S(=O)(=O)Oc1c(Cl)cc(c2c1nccc2)Cl

STK761663
Synonyms: 5,7-dichloroquinolin-8-yl2,4-dibromobenzenesulfonate
Smiles: Brc1ccc(c(c1)Br)S(=O)(=O)Oc1c(Cl)cc(c2c1nccc2)Cl

STK761664
Synonyms: 5,7-dichloroquinolin-8-ylnaphthalene-2-sulfonate
Smiles: Clc1cc(Cl)c2c(c1OS(=O)(=O)c1ccc3c(c1)cccc3)nccc2

STK761665
Synonyms: 5,7-dichloroquinolin-8-yl5-chloro-2-methylbenzenesulfonate
Smiles: Clc1ccc(c(c1)S(=O)(=O)Oc1c(Cl)cc(c2c1nccc2)Cl)C

STK676047
Synonyms: 5,7-dibromoquinolin-8-yl5-bromo-2-methoxybenzenesulfonate
Smiles: COc1ccc(cc1S(=O)(=O)Oc1c(Br)cc(c2c1nccc2)Br)Br

STK761668
Synonyms: 5-chloro-1-[(2,5-dimethylphenyl)sulfonyl]-1H-benzotriazole
Smiles: Clc1ccc2c(c1)nnn2S(=O)(=O)c1cc(C)ccc1C

STK761670
Synonyms: 5,7-dichloroquinolin-8-yl4-chloro-2-methylbenzenesulfonate
Smiles: Clc1ccc(c(c1)C)S(=O)(=O)Oc1c(Cl)cc(c2c1nccc2)Cl

STK676048
Synonyms: 5,7-dibromoquinolin-8-yl2,3,4-trichlorobenzenesulfonate
Smiles: Brc1cc(Br)c2c(c1OS(=O)(=O)c1ccc(c(c1Cl)Cl)Cl)nccc2

STK761676
Synonyms: 5,7-dichloroquinolin-8-yl2,5-dimethylbenzenesulfonate
Smiles: Cc1ccc(c(c1)S(=O)(=O)Oc1c(Cl)cc(c2c1nccc2)Cl)C

STK761677
Synonyms: 5,7-dibromoquinolin-8-ylfuran-2-carboxylate
Smiles: Brc1cc(Br)c2c(c1OC(=O)c1ccco1)nccc2

STK761678
Synonyms: N-(2,3-dimethylphenyl)-2-oxo-8-(prop-2-en-1-yl)-2H-chromene-3-carboxamide
Smiles: C=CCc1cccc2c1oc(=O)c(c2)C(=O)Nc1cccc(c1C)C

STK761685
Synonyms: 5,7-dichloroquinolin-8-ylfuran-2-carboxylate
Smiles: Clc1cc(Cl)c2c(c1OC(=O)c1ccco1)nccc2

STK761687
Synonyms: 1-[(1,1-dioxido-1,2-benzothiazol-3-yl)(methyl)amino]-3-phenoxypropan-2-yl2-bromobenzoate
Smiles: O=C(c1ccccc1Br)OC(CN(C1=NS(=O)(=O)c2c1cccc2)C)COc1ccccc1

STK761688
Synonyms: 4-[(1,1-dioxido-1,2-benzothiazol-3-yl)amino]phenyl4-methoxybenzoate
Smiles: COc1ccc(cc1)C(=O)Oc1ccc(cc1)NC1=NS(=O)(=O)c2c1cccc2

STK761689
Synonyms: 3-[(1,1-dioxido-1,2-benzothiazol-3-yl)(phenyl)amino]propyl4-methoxybenzoate
Smiles: COc1ccc(cc1)C(=O)OCCCN(C1=NS(=O)(=O)c2c1cccc2)c1ccccc1

STK676050
Synonyms: 3-(2-{[2-(2-methylphenoxy)ethyl]sulfanyl}-1H-benzimidazol-1-yl)propanoicacid
Smiles: OC(=O)CCn1c(SCCOc2ccccc2C)nc2c1cccc2

STK676053
Synonyms: [(3E)-3-{2-[(2-hydroxyphenyl)carbonyl]hydrazinylidene}-2-oxo-2,3-dihydro-1H-indol-1-yl]aceticacid
Smiles: OC(=O)CN1c2ccccc2/C(=N\NC(=O)c2ccccc2O)/C1=O

STK676054
Synonyms: {(3E)-2-oxo-3-[2-(5H-[1,2,4]triazino[5,6-b]indol-3-yl)hydrazinylidene]-2,3-dihydro-1H-indol-1-yl}aceticacid
Smiles: OC(=O)CN1C(=O)/C(=N/Nc2nnc3c(n2)[nH]c2c3cccc2)/c2c1cccc2

STK761697
Synonyms: 2-amino-4-(1,3-benzodioxol-5-yl)-1-(3-chloro-4-methylphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Smiles: N#CC1=C(N)N(c2ccc(c(c2)Cl)C)C2=C(C1c1ccc3c(c1)OCO3)C(=O)CCC2

STK761705
Synonyms: 4-[(4-chloro-3-methylphenyl)sulfonyl]morpholine
Smiles: Clc1ccc(cc1C)S(=O)(=O)N1CCOCC1

STK676057
Synonyms: 5,6-bis(2-methylpiperidin-1-yl)[1,2,5]oxadiazolo[3,4-b]pyrazine
Smiles: CC1CCCCN1c1nc2nonc2nc1N1CCCCC1C

STK761713
Synonyms: 5,7-dibromoquinolin-8-yl5-chloro-2-methylbenzenesulfonate
Smiles: Clc1ccc(c(c1)S(=O)(=O)Oc1c(Br)cc(c2c1nccc2)Br)C

STK761715
Synonyms: 5,7-dibromoquinolin-8-yl4-chloro-2-methylbenzenesulfonate
Smiles: Clc1ccc(c(c1)C)S(=O)(=O)Oc1c(Br)cc(c2c1nccc2)Br

STK761722
Synonyms: 5,7-dichloroquinolin-8-yl4-methylbenzenesulfonate
Smiles: Cc1ccc(cc1)S(=O)(=O)Oc1c(Cl)cc(c2c1nccc2)Cl

STK761723
Synonyms: 5,7-dibromoquinolin-8-yl2,5-dimethylbenzenesulfonate
Smiles: Cc1ccc(c(c1)S(=O)(=O)Oc1c(Br)cc(c2c1nccc2)Br)C

STK676062
Synonyms: 2-(1,3-benzothiazol-2-ylcarbamoyl)-4-methylbenzoicacid
Smiles: Cc1ccc(c(c1)C(=O)Nc1nc2c(s1)cccc2)C(=O)O

STK761731
Synonyms: 8,10a-dihydroxy-1,10a-dihydro-2H-chromeno[2,3-d]pyrimidine-2,4(3H)-dione
Smiles: O=C1NC(=O)C2=Cc3c(OC2(N1)O)cc(cc3)O

STK761736
Synonyms: (3E)-5-(3,4-dimethylphenyl)-3-{[1-(2-fluorophenyl)-1H-pyrrol-2-yl]methylidene}furan-2(3H)-one
Smiles: O=C1OC(=C/C/1=C\c1cccn1c1ccccc1F)c1ccc(c(c1)C)C

STK761745
Synonyms: 5-(2,4-dimethoxyphenyl)-3-hydroxy-4-[(4-methoxyphenyl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(cc1)C(=O)C1=C(O)C(=O)NC1c1ccc(cc1OC)OC

STK676066
Synonyms: 2-{[hydroxy(diphenyl)acetyl]amino}-N-(2-methylphenyl)benzamide
Smiles: O=C(c1ccccc1NC(=O)C(c1ccccc1)(c1ccccc1)O)Nc1ccccc1C

STK761750
Synonyms: (2E,5Z)-3-methyl-2-(methylimino)-5-[(3-methylthiophen-2-yl)methylidene]-1,3-thiazolidin-4-one
Smiles: C/N=C\1/S/C(=C\c2sccc2C)/C(=O)N1C

STK761754
Synonyms: 2-methoxy-4-{(Z)-[(2Z)-4-oxo-3-phenyl-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}phenyldimethylcarbamate
Smiles: COc1cc(ccc1OC(=O)N(C)C)/C=C/1\S/C(=N\c2ccccc2)/N(C1=O)c1ccccc1

STK761760
Synonyms: (2E)-2-[(1-benzyl-1H-indol-3-yl)methylidene]-7,8-dimethyl[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Smiles: Cc1ccc2c(c1C)nc1n2c(=O)/c(=C\c2cn(c3c2cccc3)Cc2ccccc2)/s1

STK761773
Synonyms: N-(2-hydroxyethyl)-2-(2-methyl-4-nitro-1H-imidazol-1-yl)acetamide
Smiles: [O-][N+](=O)c1cn(c(n1)C)CC(=O)NCCO

STK761778
Synonyms: 8-(dimethylamino)-1,3-dimethyl-7-(2-oxo-2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=C(c1ccccc1)Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N(C)C

STK676071
Synonyms: 7-[2-(4-chlorophenyl)-2-oxoethyl]-1,3-dimethyl-8-(morpholin-4-yl)-3,7-dihydro-1H-purine-2,6-dione
Smiles: Clc1ccc(cc1)C(=O)Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCOCC1

STK761784
Synonyms: (6E)-6-(furan-2-ylmethylidene)-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: O=c1/c(=C\c2ccco2)/sc2=NC3(C(Nn12)(c1ccccc1)N(C)C(=O)N3C)c1ccccc1

STK761786
Synonyms: ethyl4-(dimethylamino)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: CCOC(=O)C1=C(C)NC(=O)NC1N(C)C

STK761792
Synonyms: propan-2-yl1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(pyridin-2-ylsulfanyl)methyl]-1H-1,2,3-triazole-4-carboxylate
Smiles: CC(OC(=O)c1nnn(c1CSc1ccccn1)c1nonc1N)C

STK676076
Synonyms: propan-2-yl1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-ethylpiperazin-1-yl)methyl]-1H-1,2,3-triazole-4-carboxylate
Smiles: CCN1CCN(CC1)Cc1c(nnn1c1nonc1N)C(=O)OC(C)C

STK761796
Synonyms: 3-[(7-chloroquinolin-4-yl)amino]naphthalene-2-carboxylicacid
Smiles: Clc1ccc2c(c1)nccc2Nc1cc2ccccc2cc1C(=O)O

STK761800
Synonyms: 1'-(piperidin-1-ylmethyl)spiro[1,3-dioxane-2,3'-indol]-2'(1'H)-one
Smiles: O=C1N(CN2CCCCC2)c2c(C31OCCCO3)cccc2

STK676081
Synonyms: (3Z)-5-bromo-3-[(4-methoxyphenyl)imino]-1-[(4-methylpiperidin-1-yl)methyl]-1,3-dihydro-2H-indol-2-one
Smiles: COc1ccc(cc1)/N=C\1/c2cc(Br)ccc2N(C1=O)CN1CCC(CC1)C

STK761806
Synonyms: [4-(1,3-benzothiazol-2-yl)piperazin-1-yl](4-chlorophenyl)methanone
Smiles: Clc1ccc(cc1)C(=O)N1CCN(CC1)c1nc2c(s1)cccc2

STK676083
Synonyms: N-{(1E)-1-(furan-2-yl)-3-[(3-methylphenyl)amino]-3-oxoprop-1-en-2-yl}thiophene-3-carboxamide
Smiles: Cc1cccc(c1)NC(=O)/C(=C\c1ccco1)/NC(=O)c1ccsc1

STK761813
Synonyms: N-[(1E)-3-[(2-methoxyphenyl)amino]-3-oxo-1-(thiophen-2-yl)prop-1-en-2-yl]thiophene-3-carboxamide
Smiles: COc1ccccc1NC(=O)/C(=C\c1cccs1)/NC(=O)c1ccsc1

STK761815
Synonyms: N-[(1E)-1-(furan-2-yl)-3-oxo-3-{[3-(trifluoromethyl)phenyl]amino}prop-1-en-2-yl]thiophene-3-carboxamide
Smiles: O=C(/C(=C\c1ccco1)/NC(=O)c1cscc1)Nc1cccc(c1)C(F)(F)F

STK761820
Synonyms: (2Z)-2-(2,4-difluorobenzylidene)[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Smiles: Fc1ccc(c(c1)F)/C=c/1\sc2n(c1=O)c1c(n2)cccc1

STK761821
Synonyms: (2Z)-2-[(3-methylthiophen-2-yl)methylidene]-5,6-diphenylimidazo[2,1-b][1,3]thiazol-3(2H)-one
Smiles: Cc1ccsc1/C=c/1\sc2n(c1=O)c(c(n2)c1ccccc1)c1ccccc1

STK761823
Synonyms: propan-2-yl1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2,3-dihydro-1H-indol-1-ylmethyl)-1H-1,2,3-triazole-4-carboxylate
Smiles: CC(OC(=O)c1nnn(c1CN1CCc2c1cccc2)c1nonc1N)C

STK761824
Synonyms: N-{2-[(2-chloropyridin-3-yl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}benzamide
Smiles: O=C(c1ccccc1)NC(C(F)(F)F)(C(F)(F)F)Nc1cccnc1Cl

STK676093
Synonyms: 6,6'-benzene-1,2-diylbis(1,3,5-triazine-2,4-diamine)
Smiles: Nc1nc(nc(n1)N)c1ccccc1c1nc(N)nc(n1)N

STK761836
Synonyms: 4-(5-phenyl-1,2,4-oxadiazol-3-yl)-1,2,5-oxadiazol-3-amine
Smiles: Nc1nonc1c1noc(n1)c1ccccc1

STK761837
Synonyms: 1-phenyl-1,3a,4,4a,5,7a,8,8a-octahydro-4,8-methanoindeno[5,6-d][1,2,3]triazole
Smiles: C1=CC2C(C1)C1CC2C2C1N=NN2c1ccccc1

STK761841
Synonyms: 2-amino-5-iodo-6-(3-methoxyphenoxy)pyrimidin-4(3H)-one
Smiles: COc1cccc(c1)Oc1nc(N)[nH]c(=O)c1I

STK761842
Synonyms: 4-methoxy-6-[2-(prop-2-en-1-yl)phenoxy]pyrimidin-2-amine
Smiles: C=CCc1ccccc1Oc1cc(OC)nc(n1)N

STK761851
Synonyms: 4-(2-chlorophenyl)-5-cyano-6-(ethylsulfanyl)-2-phenyl-1,2,3,4-tetrahydropyridin-2-ylbenzoate
Smiles: CCSC1=C(C#N)C(CC(N1)(OC(=O)c1ccccc1)c1ccccc1)c1ccccc1Cl

STK761852
Synonyms: 4-(2-chlorophenyl)-5-cyano-6-(methylsulfanyl)-2-phenyl-1,2,3,4-tetrahydropyridin-2-ylbenzoate
Smiles: CSC1=C(C#N)C(CC(N1)(OC(=O)c1ccccc1)c1ccccc1)c1ccccc1Cl

STK761859
Synonyms: ethyl1-[(2-hydroxyphenyl)carbonyl]-4-phenylpiperidine-4-carboxylate
Smiles: CCOC(=O)C1(CCN(CC1)C(=O)c1ccccc1O)c1ccccc1

STK676102
Synonyms: 2,2'-{[6-(piperidin-1-yl)-1,3,5-triazine-2,4-diyl]diimino}diaceticacid(non-preferredname)
Smiles: OC(=O)CNc1nc(NCC(=O)O)nc(n1)N1CCCCC1

STK761872
Synonyms: (1S,2S,5R)-2-[3-(3,4-dimethoxyphenyl)-4-methyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-6,8-dioxabicyclo[3.2.1]octan-4-one(non-preferredname)
Smiles: COc1cc(ccc1OC)c1nn(c(=S)n1C)[C@H]1CC(=O)[C@H]2O[C@@H]1CO2

STK761874
Synonyms: (1S,2S,5R)-2-[3-(2,4-dichlorophenyl)-4-(prop-2-en-1-yl)-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]-6,8-dioxabicyclo[3.2.1]octan-4-one(non-preferredname)
Smiles: C=CCn1c(nn(c1=S)[C@H]1CC(=O)[C@H]2O[C@@H]1CO2)c1ccc(cc1Cl)Cl

STK761876
Synonyms: 4-hydroxy-3,4-dimethyl-1-oxa-3-azaspiro[4.5]decan-2-one
Smiles: CN1C(=O)OC2(C1(C)O)CCCCC2

STK761877
Synonyms: methyl3,6-diamino-5-cyano-4-(3,4-dimethoxyphenyl)thieno[2,3-b]pyridine-2-carboxylate
Smiles: N#Cc1c(N)nc2c(c1c1ccc(c(c1)OC)OC)c(N)c(s2)C(=O)OC

STK761879
Synonyms: prop-2-yn-1-ylcyclohexylidene[(phenylcarbonyl)amino]acetate
Smiles: C#CCOC(=O)C(=C1CCCCC1)NC(=O)c1ccccc1

STK761881
Synonyms: (3Z)-1-ethyl-3-(4-oxo-3-phenyl-2-thioxo-1,3-thiazolidin-5-ylidene)-1,3-dihydro-2H-indol-2-one
Smiles: CCN1C(=O)/C(=C/2\SC(=S)N(C2=O)c2ccccc2)/c2c1cccc2

STK761897
Synonyms: N-(4-chlorophenyl)-5-(3,4-dichlorophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: Clc1ccc(cc1)NC(=O)c1cc2n(n1)c(cc(n2)c1ccc(c(c1)Cl)Cl)C(F)(F)F

STK761899
Synonyms: morpholin-4-yl[7-(trifluoromethyl)-5,6-dihydrobenzo[h]pyrazolo[5,1-b]quinazolin-10-yl]methanone
Smiles: O=C(c1nn2c(c1)nc1c(c2C(F)(F)F)CCc2c1cccc2)N1CCOCC1

STK761901
Synonyms: 3-chloro-5-(4-fluorophenyl)-N-(propan-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: CC(NC(=O)c1nn2c(c1Cl)nc(cc2C(F)(F)F)c1ccc(cc1)F)C

STK761905
Synonyms: 3-chloro-5-(4-fluorophenyl)-N-(2-methoxyethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: COCCNC(=O)c1nn2c(c1Cl)nc(cc2C(F)(F)F)c1ccc(cc1)F

STK761916
Synonyms: 5-(4-methylphenyl)-N-(propan-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
Smiles: CC(NC(=O)c1cnn2c1nc(cc2C(F)(F)F)c1ccc(cc1)C)C

STK761926
Synonyms: methyl2,4-dihydroxy-1-(4-methoxyphenyl)-5-oxo-3-(phenylcarbonyl)-2,5-dihydro-1H-pyrrole-2-carboxylate
Smiles: COC(=O)C1(O)N(c2ccc(cc2)OC)C(=O)C(=C1C(=O)c1ccccc1)O

STK676127
Synonyms: 4-({(Z)-[1-(4-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)benzoicacid
Smiles: Clc1ccc(cc1)N1N=C(/C(=C/Nc2ccc(cc2)C(=O)O)/C1=O)C

STK761940
Synonyms: (4Z)-4-(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-1-(3,4-dichlorophenyl)pyrazolidine-3,5-dione
Smiles: Brc1ccc2c(c1)/C(=C/1\C(=O)NN(C1=O)c1ccc(c(c1)Cl)Cl)/C(=O)N2

STK761941
Synonyms: ethyl4-cyano-3-methyl-5-({(Z)-[1-(3-methylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}amino)thiophene-2-carboxylate
Smiles: CCOC(=O)c1sc(c(c1C)C#N)N/C=C\1/C(=O)NC(=O)N(C1=O)c1cccc(c1)C

STK761942
Synonyms: ethyl2-({(Z)-[1-(4-chlorophenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: CCOC(=O)c1c(N/C=C\2/C(=O)NC(=O)N(C2=O)c2ccc(cc2)Cl)sc2c1CCCC2

STK761943
Synonyms: (5Z)-5-{[(4-bromophenyl)amino]methylidene}-1-(3-chlorophenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Brc1ccc(cc1)N/C=C\1/C(=O)NC(=O)N(C1=O)c1cccc(c1)Cl

STK761944
Synonyms: (5Z)-5-{[(5-chloro-2-hydroxyphenyl)amino]methylidene}-1-(4-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Cc1ccc(cc1)N1C(=O)NC(=O)/C(=C/Nc2cc(Cl)ccc2O)/C1=O

STK676130
Synonyms: 2-[3,5-dimethyl-1-(4-nitrophenyl)-1H-pyrazol-4-yl]-5,8-dinitro-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: [O-][N+](=O)c1ccc(cc1)n1nc(c(c1C)n1c(=O)c2cc(cc3c2c(c1=O)cc(c3)[N+](=O)[O-])[N+](=O)[O-])C

STK761946
Synonyms: 4-({(Z)-[1-(3,4-dimethylphenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)-N,N-dimethylbenzamide
Smiles: CN(C(=O)c1ccc(cc1)N/C=C\1/C(=NN(C1=O)c1ccc(c(c1)C)C)C)C

STK761947
Synonyms: N-[3-({(Z)-[1-(4-fluorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)phenyl]acetamide
Smiles: CC(=O)Nc1cccc(c1)N/C=C\1/C(=NN(C1=O)c1ccc(cc1)F)C

STK761948
Synonyms: propyl5-(5-bromo-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)-2-chlorobenzoate
Smiles: CCCOC(=O)c1cc(ccc1Cl)n1c(=O)c2cccc3c2c(c1=O)cc(c3)Br

STK761952
Synonyms: N-[3-methyl-4-(2-oxo-2H-chromen-3-yl)phenyl]-2-phenylacetamide
Smiles: O=C(Cc1ccccc1)Nc1ccc(c(c1)C)c1cc2ccccc2oc1=O

STK761973
Synonyms: 3-chloro-5-(3,4-dimethoxyphenyl)-N-(propan-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: COc1cc(ccc1OC)c1cc(n2c(n1)c(Cl)c(n2)C(=O)NC(C)C)C(F)(F)F

STK761976
Synonyms: propan-2-yl5-(4-methylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxylate
Smiles: CC(OC(=O)c1cnn2c1nc(cc2C(F)(F)F)c1ccc(cc1)C)C

STK676145
Synonyms: N-[3-(2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undec-1-yl)propyl]acetamide
Smiles: CC(=O)NCCC[Si]12OCCN(CCO1)CCO2

STK761980
Synonyms: 4-(2-methylphenyl)-2,4-dihydro[1,2,4]triazolo[4,3-a]quinazoline-1,5-dione
Smiles: O=c1n(c2ccccc2C)c2n[nH]c(=O)n2c2c1cccc2

STK761984
Synonyms: 4-phenyl-3-[(2E)-3-phenylprop-2-enoyl]quinolin-2(1H)-one
Smiles: O=C(c1c(=O)[nH]c2c(c1c1ccccc1)cccc2)/C=C/c1ccccc1

STK761985
Synonyms: 6-bromo-3-[(2E)-3-(4-methoxyphenyl)prop-2-enoyl]-4-phenylquinolin-2(1H)-one
Smiles: COc1ccc(cc1)/C=C/C(=O)c1c(=O)[nH]c2c(c1c1ccccc1)cc(cc2)Br

STK676148
Synonyms: diethyl2-{[(4-methylpiperazin-1-yl)acetyl]amino}-4,7-dihydrothieno[2,3-c]pyridine-3,6(5H)-dicarboxylate
Smiles: CCOC(=O)c1c(NC(=O)CN2CCN(CC2)C)sc2c1CCN(C2)C(=O)OCC

STK676149
Synonyms: 6-{(E)-2-[4-(morpholin-4-yl)-3-nitrophenyl]ethenyl}-5-nitropyrimidine-2,4-diol
Smiles: Oc1nc(/C=C/c2ccc(c(c2)[N+](=O)[O-])N2CCOCC2)c(c(n1)O)[N+](=O)[O-]

STK761986
Synonyms: N-{1-[4-(diphenylmethyl)piperazin-1-yl]-2-methylpropan-2-yl}benzenesulfonamide
Smiles: CC(NS(=O)(=O)c1ccccc1)(CN1CCN(CC1)C(c1ccccc1)c1ccccc1)C

STK761988
Synonyms: 4-(6-methyl-1,3-benzothiazol-2-yl)phenyl3-iodobenzoate
Smiles: Ic1cccc(c1)C(=O)Oc1ccc(cc1)c1sc2c(n1)ccc(c2)C

STK761993
Synonyms: N-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]-3-iodobenzamide
Smiles: Ic1cccc(c1)C(=O)Nc1ccc(c(c1)c1nc2c([nH]1)cccc2)Cl

STK761995
Synonyms: 5-(4-chlorophenyl)-N-[2-(4-fluorophenyl)-1,3-benzoxazol-5-yl]furan-2-carboxamide
Smiles: Fc1ccc(cc1)c1oc2c(n1)cc(cc2)NC(=O)c1ccc(o1)c1ccc(cc1)Cl

STK761997
Synonyms: 5-(4-chlorophenyl)-N-[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]furan-2-carboxamide
Smiles: Clc1ccc(cc1)c1ccc(o1)C(=O)Nc1ccc2c(c1)nc(o2)c1cccnc1

STK762006
Synonyms: N-benzyl-N-(pyridin-2-yl)tricyclo[3.3.1.1~3,7~]decane-1-carboxamide
Smiles: O=C(C12CC3CC(C2)CC(C1)C3)N(c1ccccn1)Cc1ccccc1

STK762011
Synonyms: 6-iodo-3-(4-methoxyphenyl)-2-methylquinazolin-4(3H)-one
Smiles: COc1ccc(cc1)n1c(C)nc2c(c1=O)cc(cc2)I

STK762014
Synonyms: 4-ethoxy-N-[3-methyl-4-(2-oxo-2H-chromen-3-yl)phenyl]-3-nitrobenzamide
Smiles: CCOc1ccc(cc1[N+](=O)[O-])C(=O)Nc1ccc(c(c1)C)c1cc2ccccc2oc1=O

STK676154
Synonyms: 5-(3,4-dimethoxyphenyl)-1,3-dithiane1,1,3,3-tetraoxide
Smiles: COc1cc(ccc1OC)C1CS(=O)(=O)CS(=O)(=O)C1

STK762024
Synonyms: (2E,5E)-2,5-bis(4-methylbenzylidene)cyclopentanone
Smiles: O=C1/C(=C/c2ccc(cc2)C)/CC/C/1=C\c1ccc(cc1)C

STK762025
Synonyms: 3-(1,3-benzothiazol-2-yl)-7-hydroxy-6-propyl-2-(trifluoromethyl)-4H-chromen-4-one
Smiles: CCCc1cc2c(cc1O)oc(c(c2=O)c1nc2c(s1)cccc2)C(F)(F)F

STK762027
Synonyms: 4-(4-fluorophenyl)-6-oxo-2-(propylsulfanyl)-1,4,5,6-tetrahydropyridine-3-carbonitrile
Smiles: CCCSC1=C(C#N)C(CC(=O)N1)c1ccc(cc1)F

STK762029
Synonyms: propyl({3-cyano-6-oxo-4-[4-(propan-2-yl)phenyl]-1,4,5,6-tetrahydropyridin-2-yl}sulfanyl)acetate
Smiles: CCCOC(=O)CSC1=C(C#N)C(CC(=O)N1)c1ccc(cc1)C(C)C

STK762035
Synonyms: N-[3-(diethylamino)propyl]-5-(4-methylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
Smiles: CCN(CCCNC(=O)c1cnn2c1nc(cc2C(F)(F)F)c1ccc(cc1)C)CC

STK676160
Synonyms: 2,6-dibromo-4-(morpholin-4-ylcarbonothioyl)phenyl4-methylbenzenesulfonate
Smiles: Cc1ccc(cc1)S(=O)(=O)Oc1c(Br)cc(cc1Br)C(=S)N1CCOCC1

STK762038
Synonyms: 1-{2-[(2,6-dichlorophenyl)amino]-4,5-dihydro-1H-imidazol-1-yl}ethanone
Smiles: CC(=O)N1CCN=C1Nc1c(Cl)cccc1Cl

STK762041
Synonyms: 7-[(2E)-but-2-en-1-yl]-3-methyl-8-[(2-methylpropyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: C/C=C/Cn1c(SCC(C)C)nc2c1c(=O)[nH]c(=O)n2C

STK762042
Synonyms: 7-[(2E)-but-2-en-1-yl]-3-methyl-8-[(3-methylbutyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: C/C=C/Cn1c(SCCC(C)C)nc2c1c(=O)[nH]c(=O)n2C

STK762052
Synonyms: N-[3-(3-bromophenyl)-1-phenyl-1H-pyrazol-5-yl]acetamide
Smiles: CC(=O)Nc1cc(nn1c1ccccc1)c1cccc(c1)Br

STK762055
Synonyms: 1,1-dioxidotetrahydrothiophen-3-ylphenylcarbamate
Smiles: O=C(Nc1ccccc1)OC1CCS(=O)(=O)C1

STK762057
Synonyms: (5Z)-3-(4-methylphenyl)-5-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)-1,3-thiazolidine-2,4-dione
Smiles: Cc1ccc(cc1)N1C(=O)S/C(=C/2\C(=O)Nc3c2cccc3)/C1=O

STK762059
Synonyms: 4-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)-N-(pyridin-3-ylmethyl)butanamide
Smiles: O=C(NCc1cccnc1)CCCn1c(=O)c2cccc3c2c(c1=O)ccc3

STK676181
Synonyms: 2-{2-[4-(2,4-dinitrophenyl)piperazin-1-yl]ethyl}-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: [O-][N+](=O)c1cc(ccc1N1CCN(CC1)CCn1c(=O)c2cccc3c2c(c1=O)ccc3)[N+](=O)[O-]

STK762063
Synonyms: (3Z)-3-[3-(2,3-dimethylphenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]-1,3-dihydro-2H-indol-2-one
Smiles: S=C1S/C(=C/2\C(=O)Nc3c2cccc3)/C(=O)N1c1cccc(c1C)C

STK762064
Synonyms: (3Z)-3-[3-(3,4-dimethylphenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]-1-methyl-1,3-dihydro-2H-indol-2-one
Smiles: S=C1S/C(=C\2/c3ccccc3N(C2=O)C)/C(=O)N1c1ccc(c(c1)C)C

STK762065
Synonyms: N-(4-nitrophenyl)thiophene-2-sulfonamide
Smiles: [O-][N+](=O)c1ccc(cc1)NS(=O)(=O)c1cccs1

STK762067
Synonyms: 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-9H-purin-9-yl)acetohydrazide
Smiles: NNC(=O)Cn1cnc2c1n(C)c(=O)n(c2=O)C

STK762070
Synonyms: 6-(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-ylamino)hexanoicacid
Smiles: OC(=O)CCCCCNc1ncnc2c1c1CCCCc1s2

STK762071
Synonyms: 1-(3,6-dichloro-9H-carbazol-9-yl)-3-(3,5-diphenyl-1H-pyrazol-1-yl)propan-2-ol
Smiles: OC(Cn1c2ccc(cc2c2c1ccc(c2)Cl)Cl)Cn1nc(cc1c1ccccc1)c1ccccc1

STK762072
Synonyms: 3-(2-nitro-1-phenylethyl)-1H-indole
Smiles: [O-][N+](=O)CC(c1c[nH]c2c1cccc2)c1ccccc1

STK676183
Synonyms: 1-(3,6-diiodo-9H-carbazol-9-yl)-3-[(4-ethoxyphenyl)amino]propan-2-ol
Smiles: CCOc1ccc(cc1)NCC(Cn1c2ccc(cc2c2c1ccc(c2)I)I)O

STK676184
Synonyms: 1-(3,6-diiodo-9H-carbazol-9-yl)-3-(naphthalen-1-ylamino)propan-2-ol
Smiles: OC(Cn1c2ccc(cc2c2c1ccc(c2)I)I)CNc1cccc2c1cccc2

STK676185
Synonyms: 1-(3,6-diiodo-9H-carbazol-9-yl)-3-[(4-iodophenyl)amino]propan-2-ol
Smiles: Ic1ccc(cc1)NCC(Cn1c2ccc(cc2c2c1ccc(c2)I)I)O

STK762073
Synonyms: 1-(3,6-dibromo-9H-carbazol-9-yl)-3-[(2,3-dimethylphenyl)amino]propan-2-ol
Smiles: OC(Cn1c2ccc(cc2c2c1ccc(c2)Br)Br)CNc1cccc(c1C)C

STK762082
Synonyms: ethylN-{4-chloro-6-[(4-iodophenyl)amino]-1,3,5-triazin-2-yl}glycinate
Smiles: CCOC(=O)CNc1nc(Nc2ccc(cc2)I)nc(n1)Cl

STK762083
Synonyms: 6-chloro-N-(furan-2-ylmethyl)-N'-hexyl-1,3,5-triazine-2,4-diamine
Smiles: CCCCCCNc1nc(Cl)nc(n1)NCc1ccco1

STK762085
Synonyms: 6-(2-methylpropoxy)-2,3,4,9-tetrahydro-1H-carbazol-1-one
Smiles: CC(COc1ccc2c(c1)c1CCCC(=O)c1[nH]2)C

STK762088
Synonyms: N-[5-(1H-benzimidazol-2-yl)-2-methylphenyl]-4-methyl-3-nitrobenzamide
Smiles: Cc1ccc(cc1NC(=O)c1ccc(c(c1)[N+](=O)[O-])C)c1nc2c([nH]1)cccc2

STK762096
Synonyms: N-(4-methylphenyl)-1H-1,2,4-triazole-3-carboxamide
Smiles: Cc1ccc(cc1)NC(=O)c1n[nH]cn1

STK762098
Synonyms: N-[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-5-yl]acetamide
Smiles: CC(=O)Nc1cc(nn1c1ccccc1)c1ccc(cc1)Cl

STK762099
Synonyms: 1,1'-{4-[(4-bromophenyl)amino]-6-hydroxy-6-methyl-2-(4-methylphenyl)cyclohex-3-ene-1,3-diyl}diethanone
Smiles: Cc1ccc(cc1)C1C(=C(Nc2ccc(cc2)Br)CC(C1C(=O)C)(C)O)C(=O)C

STK762100
Synonyms: 4-[(4-bromophenyl)carbonyl]-3-hydroxy-5-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(cc1)C1NC(=O)C(=C1C(=O)c1ccc(cc1)Br)O

STK762114
Synonyms: ethyl1-(4-chlorobenzyl)-5-methyl-1H-pyrazole-4-carboxylate
Smiles: CCOC(=O)c1cnn(c1C)Cc1ccc(cc1)Cl

STK762128
Synonyms: 5-(6-amino-9H-purin-9-yl)-N-ethyl-3,4-dihydroxytetrahydrofuran-2-carboxamide(non-preferredname)
Smiles: CCNC(=O)C1OC(C(C1O)O)n1cnc2c1ncnc2N

STK762131
Synonyms: (4Z)-4-{[5-(2-bromo-5-nitrophenyl)furan-2-yl]methylidene}-5-methyl-2-(4-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: Cc1ccc(cc1)N1N=C(/C(=C/c2ccc(o2)c2cc(ccc2Br)[N+](=O)[O-])/C1=O)C

STK762141
Synonyms: 4-{(4Z)-4-[(5Z)-3-ethyl-5-(5-methoxy-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-4-oxo-1,3-thiazolidin-2-ylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}benzoicacid
Smiles: COc1ccc2c(c1)n(C)/c(=c\1/s/c(=C\3/C(=NN(C3=O)c3ccc(cc3)C(=O)O)C)/n(c1=O)CC)/s2

STK762149
Synonyms: 2-(2-hydroxyethyl)-6-(piperidin-1-yl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: OCCn1c(=O)c2ccc(c3c2c(c1=O)ccc3)N1CCCCC1

STK762163
Synonyms: 6-acetyl-2-(1,3,5-trimethyl-1H-pyrazol-4-yl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: CC(=O)c1ccc2c3c1cccc3c(=O)n(c2=O)c1c(C)nn(c1C)C

STK762186
Synonyms: 4-acetyl-1-(4-fluorophenyl)-3-hydroxy-5-(4-methylphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: Cc1ccc(cc1)C1C(=C(C(=O)N1c1ccc(cc1)F)O)C(=O)C

STK762190
Synonyms: 4-bromophenyl3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazole-5-carboxylate
Smiles: Brc1ccc(cc1)OC(=O)c1cc2c(s1)n(nc2C)c1ccccc1

STK762192
Synonyms: 4,8-dimethoxyfuro[2,3-b]quinolin-7-ol
Smiles: COc1c(O)ccc2c1nc1occc1c2OC

STK762195
Synonyms: N-phenylazepane-1-carboxamide
Smiles: O=C(N1CCCCCC1)Nc1ccccc1

STK762207
Synonyms: 7-methoxy-5-methyl-3-(4-methyl-1,3-thiazol-2-yl)-4H-chromen-4-one
Smiles: COc1cc(C)c2c(c1)occ(c2=O)c1scc(n1)C

STK762221
Synonyms: 6-[(3-phenoxybenzyl)sulfanyl]-5-thioxo-4,5-dihydro-1,2,4-triazin-3(2H)-one
Smiles: S=c1[nH]c(=O)[nH]nc1SCc1cccc(c1)Oc1ccccc1

STK762230
Synonyms: 6-bromo-2-(1,3,5-trimethyl-1H-pyrazol-4-yl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: Brc1ccc2c3c1cccc3c(=O)n(c2=O)c1c(C)nn(c1C)C

STK762231
Synonyms: 5-amino-3-[(Z)-1-cyano-2-(5-methylfuran-2-yl)ethenyl]-1-phenyl-1H-pyrazole-4-carbonitrile
Smiles: N#C/C(=C\c1ccc(o1)C)/c1nn(c(c1C#N)N)c1ccccc1

STK762232
Synonyms: N-methyl-5,7-dinitroquinolin-8-amine
Smiles: CNc1c(cc(c2c1nccc2)[N+](=O)[O-])[N+](=O)[O-]

STK762248
Synonyms: propyl4-(5-bromo-1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)benzoate
Smiles: CCCOC(=O)c1ccc(cc1)n1c(=O)c2cccc3c2c(c1=O)cc(c3)Br

STK762249
Synonyms: (4Z)-4-{[(2,3-dichlorophenyl)amino]methylidene}-5-methyl-2-(2,4,6-trichlorophenyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: Clc1cc(Cl)c(c(c1)Cl)N1N=C(/C(=C/Nc2cccc(c2Cl)Cl)/C1=O)C

STK762250
Synonyms: N-[(Z)-1-(1H-benzimidazol-2-yl)-2-(4-methylphenyl)ethenyl]-4-methylbenzamide
Smiles: Cc1ccc(cc1)/C=C(/c1nc2c([nH]1)cccc2)\NC(=O)c1ccc(cc1)C

STK762251
Synonyms: 4-[(1,1,1,3,3,3-hexafluoropropan-2-yl)oxy]-6-hydrazinyl-N-(2-nitrophenyl)-1,3,5-triazin-2-amine
Smiles: NNc1nc(nc(n1)OC(C(F)(F)F)C(F)(F)F)Nc1ccccc1[N+](=O)[O-]

STK762256
Synonyms: (4Z)-4-{[(5-chloro-2-methoxy-4-nitrophenyl)amino]methylidene}-2-(4-iodophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1cc([N+](=O)[O-])c(cc1N/C=C\1/C(=NN(C1=O)c1ccc(cc1)I)C)Cl

STK762257
Synonyms: (5Z)-1-(3-chlorophenyl)-5-[(pyridin-2-ylamino)methylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Clc1cccc(c1)N1C(=O)NC(=O)/C(=C/Nc2ccccn2)/C1=O

STK762258
Synonyms: (4Z)-4-{[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]methylidene}-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: CCc1nnc(s1)N/C=C\1/C(=NN(C1=O)c1ccc(cc1)F)C

STK762259
Synonyms: (4Z)-2-(4-bromophenyl)-4-{[(5-chloro-2-methoxy-4-nitrophenyl)amino]methylidene}-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1cc([N+](=O)[O-])c(cc1N/C=C\1/C(=NN(C1=O)c1ccc(cc1)Br)C)Cl

STK676213
Synonyms: (4Z)-5-methyl-2-(4-methylphenyl)-4-[(1H-tetrazol-5-ylamino)methylidene]-2,4-dihydro-3H-pyrazol-3-one
Smiles: Cc1ccc(cc1)N1N=C(/C(=C/Nc2nnn[nH]2)/C1=O)C

STK762261
Synonyms: (5Z)-1-(3-chlorophenyl)-5-({[5-(2,4-dichlorophenyl)-1,3,4-thiadiazol-2-yl]amino}methylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Clc1ccc(c(c1)Cl)c1nnc(s1)N/C=C\1/C(=O)NC(=O)N(C1=O)c1cccc(c1)Cl

STK762262
Synonyms: 4-({(Z)-[1-(4-chlorophenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}amino)-N,N-dimethylbenzamide
Smiles: Clc1ccc(cc1)N1C(=O)NC(=O)/C(=C/Nc2ccc(cc2)C(=O)N(C)C)/C1=O

STK762263
Synonyms: (4Z)-4-{[(5-chloro-2-methoxy-4-nitrophenyl)amino]methylidene}-2-(3-chlorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1cc([N+](=O)[O-])c(cc1N/C=C\1/C(=NN(C1=O)c1cccc(c1)Cl)C)Cl

STK762264
Synonyms: 4-({(Z)-[1-(4-bromophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)-3-methoxyphenylthiocyanate
Smiles: N#CSc1ccc(c(c1)OC)N/C=C\1/C(=NN(C1=O)c1ccc(cc1)Br)C

STK762266
Synonyms: (5Z)-5-{[(5-chloro-2-hydroxyphenyl)amino]methylidene}-1-(3-chlorophenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Clc1ccc(c(c1)N/C=C\1/C(=O)NC(=O)N(C1=O)c1cccc(c1)Cl)O

STK762268
Synonyms: diethyl5-({(Z)-[1-(2,4-dimethylphenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)-3-methylthiophene-2,4-dicarboxylate
Smiles: CCOC(=O)c1c(N/C=C\2/C(=NN(C2=O)c2ccc(cc2C)C)C)sc(c1C)C(=O)OCC

STK762275
Synonyms: N-[3-(1H-benzimidazol-2-yl)-4-chlorophenyl]-3-chlorobenzamide
Smiles: Clc1cccc(c1)C(=O)Nc1ccc(c(c1)c1nc2c([nH]1)cccc2)Cl

STK762279
Synonyms: 5-(4-methylphenyl)-7-(trifluoromethyl)-N-[3-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
Smiles: Cc1ccc(cc1)c1nc2cc(nn2c(c1)C(F)(F)F)C(=O)Nc1cccc(c1)C(F)(F)F

STK762280
Synonyms: [5-(4-methylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl](4-methylpiperidin-1-yl)methanone
Smiles: CC1CCN(CC1)C(=O)c1nn2c(c1)nc(cc2C(F)(F)F)c1ccc(cc1)C

STK762305
Synonyms: 15H-indeno[1',2':5,6]pyrazino[2,3-b]phenazin-15-one
Smiles: O=C1c2ccccc2c2c1nc1cc3nc4ccccc4nc3cc1n2

STK762307
Synonyms: N-(3-chlorophenyl)-N'-(2,5-dimethoxyphenyl)[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine
Smiles: COc1ccc(c(c1)Nc1nc2nonc2nc1Nc1cccc(c1)Cl)OC

STK762311
Synonyms: (6,7-dimethoxy-3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)acetonitrile
Smiles: N#CCC1=NC(C)(C)Cc2c1cc(OC)c(c2)OC

STK676233
Synonyms: (4Z)-2-(3-bromophenyl)-5-methyl-4-[(5-nitrofuran-2-yl)methylidene]-2,4-dihydro-3H-pyrazol-3-one
Smiles: Brc1cccc(c1)N1N=C(/C(=C/c2ccc(o2)[N+](=O)[O-])/C1=O)C

STK676234
Synonyms: 4-fluoro-6-phenoxypyrimidin-2-amine
Smiles: Fc1cc(Oc2ccccc2)nc(n1)N

STK676237
Synonyms: 1-(8-methyl-1,2,3a,4,5,6-hexahydro-3H-pyrazino[3,2,1-jk]carbazol-3-yl)-3-(2-methylphenoxy)propan-2-ol
Smiles: OC(CN1CCn2c3C1CCCc3c1c2ccc(c1)C)COc1ccccc1C

STK762320
Synonyms: 3,5-bis(phenylamino)-4H-1,2,6-thiadiazin-4-one
Smiles: O=c1c(nsnc1Nc1ccccc1)Nc1ccccc1

STK676247
Synonyms: 7-nitro-5-(pyrrolidin-1-ylmethyl)quinolin-8-ol
Smiles: Oc1c2ncccc2c(cc1[N+](=O)[O-])CN1CCCC1

STK762326
Synonyms: 1-[4-(6-nitro-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethanone
Smiles: O=C(N1CCN(CC1)c1nc2c(s1)cc(cc2)[N+](=O)[O-])CSc1nnnn1c1ccccc1

STK676250
Synonyms: N-(4-chlorophenyl)-N'-(2,3-dimethylphenyl)[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine
Smiles: Clc1ccc(cc1)Nc1nc2nonc2nc1Nc1cccc(c1C)C

STK762332
Synonyms: (5E)-5-(4-ethoxy-3-methoxybenzylidene)-3-(piperidin-1-ylmethyl)-1,3-thiazolidine-2,4-dione
Smiles: CCOc1ccc(cc1OC)/C=C\1/SC(=O)N(C1=O)CN1CCCCC1

STK762334
Synonyms: N-[2-(biphenyl-2-yloxy)-5-(trifluoromethyl)phenyl]-2-hydroxybenzamide
Smiles: O=C(c1ccccc1O)Nc1cc(ccc1Oc1ccccc1c1ccccc1)C(F)(F)F

STK762336
Synonyms: 1,4-dimethyl-9H-thioxanthen-9-one
Smiles: Cc1ccc(c2c1sc1ccccc1c2=O)C

STK762338
Synonyms: 8-chloro-1,3-dimethyl-7-[2-oxo-2-(piperidin-1-yl)ethyl]-3,7-dihydro-1H-purine-2,6-dione
Smiles: O=C(N1CCCCC1)Cn1c(Cl)nc2c1c(=O)n(C)c(=O)n2C

STK762345
Synonyms: 3'-(3-bromo-4-methylphenyl)-4'H-spiro[indole-3,2'-[1,3]thiazolidine]-2,4'(1H)-dione
Smiles: O=C1CSC2(N1c1ccc(c(c1)Br)C)C(=O)Nc1c2cccc1

STK676258
Synonyms: 5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7(3H)-one
Smiles: Cc1cc(=O)n2c(n1)[nH]cn2

STK676260
Synonyms: N-(2-fluorophenyl)-N'-(4-methylphenyl)[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine
Smiles: Cc1ccc(cc1)Nc1nc2nonc2nc1Nc1ccccc1F

STK676261
Synonyms: N-(4-chlorophenyl)-N'-methyl[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine
Smiles: CNc1nc2nonc2nc1Nc1ccc(cc1)Cl

STK676266
Synonyms: 2,3,6,7-tetramethylquinoxaline
Smiles: Cc1cc2nc(C)c(nc2cc1C)C

STK762353
Synonyms: 2-benzyl-6,7-dimethoxy-1-methylisoquinolin-3(2H)-one
Smiles: COc1cc2c(cc1OC)cc(=O)n(c2C)Cc1ccccc1

STK676267
Synonyms: 4-(4-bromophenyl)-1-chloro-2-[(2-nitrophenyl)sulfanyl]-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline-8-carboxylicacid
Smiles: Brc1ccc(cc1)C1Nc2ccc(cc2C2C1CC(C2Cl)Sc1ccccc1[N+](=O)[O-])C(=O)O

STK762356
Synonyms: 3'-(3,4-dimethylphenyl)-1-[(4-phenylpiperazin-1-yl)methyl]-4'H-spiro[indole-3,2'-[1,3]thiazolidine]-2,4'(1H)-dione
Smiles: O=C1CSC2(N1c1ccc(c(c1)C)C)C(=O)N(c1c2cccc1)CN1CCN(CC1)c1ccccc1

STK762363
Synonyms: methyl[(7-ethyl-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetate
Smiles: COC(=O)CSc1nc2c(n1CC)c(=O)n(c(=O)n2C)C

STK676276
Synonyms: 4-{5-[(2,4,6-trimethylbenzyl)sulfanyl]-1H-tetrazol-1-yl}benzoicacid
Smiles: Cc1cc(C)c(c(c1)C)CSc1nnnn1c1ccc(cc1)C(=O)O

STK676282
Synonyms: 12-{[(2,5-dimethoxy-2,5-dihydrofuran-2-yl)methyl]carbamoyl}-9,10-dihydro-9,10-ethanoanthracene-11-carboxylicacid
Smiles: COC1C=CC(O1)(OC)CNC(=O)C1C2c3ccccc3C(C1C(=O)O)c1c2cccc1

STK676286
Synonyms: (1E)-2-(bicyclo[2.2.1]hept-5-en-2-yl)-1-[3-(morpholin-4-yl)-5-nitro-1-benzofuran-2(3H)-ylidene]propan-2-ol
Smiles: [O-][N+](=O)c1ccc2c(c1)C(N1CCOCC1)/C(=C\C(C1CC3CC1C=C3)(O)C)/O2

STK762373
Synonyms: 5-acetyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Smiles: O=C1CCN(c2c(N1)cccc2)C(=O)C

STK762374
Synonyms: 5-acetyl-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Smiles: O=C1CC(C)N(c2c(N1)cccc2)C(=O)C

STK676289
Synonyms: 5-acetyl-3-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Smiles: O=C1Nc2ccccc2N(CC1C)C(=O)C

STK676290
Synonyms: 5-propanoyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Smiles: CCC(=O)N1CCC(=O)Nc2c1cccc2

STK762378
Synonyms: 5-[(2-chlorophenyl)carbonyl]-4-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Smiles: O=C1Nc2ccccc2N(C(C1)C)C(=O)c1ccccc1Cl

STK762380
Synonyms: 3-methyl-1,5-dipropanoyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Smiles: CCC(=O)N1CC(C)C(=O)N(c2c1cccc2)C(=O)CC

STK762382
Synonyms: 5-acetyl-1-benzyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Smiles: O=C1CCN(c2c(N1Cc1ccccc1)cccc2)C(=O)C

STK762383
Synonyms: 5-acetyl-1-(3-methylbutyl)-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Smiles: CC(CCN1C(=O)CCN(c2c1cccc2)C(=O)C)C

STK762384
Synonyms: 1-benzyl-3-methyl-5-propanoyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Smiles: CCC(=O)N1CC(C)C(=O)N(c2c1cccc2)Cc1ccccc1

STK676299
Synonyms: 5-acetyl-1-benzyl-4-phenyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Smiles: CC(=O)N1c2ccccc2N(C(=O)CC1c1ccccc1)Cc1ccccc1

STK762386
Synonyms: 5-benzyl-4-oxo-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-1-carbaldehyde
Smiles: O=CN1CCC(=O)N(c2c1cccc2)Cc1ccccc1

STK762388
Synonyms: 5-benzyl-2-methyl-4-oxo-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-1-carbaldehyde
Smiles: O=CN1C(C)CC(=O)N(c2c1cccc2)Cc1ccccc1

STK676302
Synonyms: 1-(prop-2-en-1-yl)-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Smiles: C=CCN1C(=O)CCNc2c1cccc2

STK676303
Synonyms: 1-methyl-4-phenyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Smiles: O=C1CC(Nc2c(N1C)cccc2)c1ccccc1

STK676304
Synonyms: 1,4,5-trimethyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Smiles: CC1CC(=O)N(c2c(N1C)cccc2)C

STK676305
Synonyms: 5-ethyl-1-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Smiles: CCN1CCC(=O)N(c2c1cccc2)C

STK762392
Synonyms: 1,4-dimethyl-7-nitro-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Smiles: CC1CC(=O)N(c2c(N1)cc(cc2)[N+](=O)[O-])C

STK676308
Synonyms: 4,5-dimethyl-7-nitro-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Smiles: O=C1CC(C)N(c2c(N1)ccc(c2)[N+](=O)[O-])C

STK676309
Synonyms: 1-benzyl-N-cyclohexyl-2-methyl-2,3-dihydro-1H-1,5-benzodiazepin-4-amine
Smiles: CC1CC(=Nc2c(N1Cc1ccccc1)cccc2)NC1CCCCC1

STK762394
Synonyms: N'-(1,2-dimethyl-2,3-dihydro-1H-1,5-benzodiazepin-4-yl)benzohydrazide
Smiles: O=C(c1ccccc1)NNC1=Nc2ccccc2N(C(C1)C)C

STK762395
Synonyms: 8-amino-2-methyl-4-oxo-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine-1-carbaldehyde
Smiles: O=CN1C(C)CC(=O)Nc2c1cc(N)cc2

STK676312
Synonyms: 1,5-diacetyl-3-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Smiles: CC1CN(C(=O)C)c2c(N(C1=O)C(=O)C)cccc2

STK762400
Synonyms: 1-(3,7-dimethyl-1,4-dioxidoquinoxalin-2-yl)ethanone
Smiles: Cc1ccc2c(c1)[n+]([O-])c(c([n+]2[O-])C)C(=O)C

STK762401
Synonyms: N-(2-fluorophenyl)-N'-phenyl[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine
Smiles: Fc1ccccc1Nc1nc2nonc2nc1Nc1ccccc1

STK676313
Synonyms: ethyl4-{[6-(methylamino)[1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)Nc1nc2nonc2nc1NC

STK762415
Synonyms: 5-(dibenzo[b,d]thiophen-3-yl)-2-(4-fluorophenyl)-4-phenyl-1H-imidazole
Smiles: Fc1ccc(cc1)c1nc(c([nH]1)c1ccc2c(c1)sc1c2cccc1)c1ccccc1

STK676318
Synonyms: 4-(dimethylamino)-6-methoxy-1,3,5-triazine-2-carbonitrile
Smiles: COc1nc(C#N)nc(n1)N(C)C

STK762416
Synonyms: [8-chloro-4-(cyclohex-3-en-1-yl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-6-yl](phenyl)methanone
Smiles: Clc1cc2C3C=CCC3C(Nc2c(c1)C(=O)c1ccccc1)C1CCC=CC1

STK762417
Synonyms: 1-chloro-4-(2-fluorophenyl)-2-[(2-nitrophenyl)sulfanyl]-2,3,3a,4,5,11c-hexahydro-1H-benzo[f]cyclopenta[c]quinoline
Smiles: Fc1ccccc1C1Nc2ccc3c(c2C2C1CC(C2Cl)Sc1ccccc1[N+](=O)[O-])cccc3

STK762425
Synonyms: 8-chloro-9-nitro-4-phenyl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-6-ol
Smiles: Oc1cc(Cl)c(c2c1NC(c1ccccc1)C1C2C=CC1)[N+](=O)[O-]

STK676323
Synonyms: 1-chloro-4-(2-fluorophenyl)-2-[(2-nitrophenyl)sulfanyl]-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline-8-carboxylicacid
Smiles: ClC1C(Sc2ccccc2[N+](=O)[O-])CC2C1c1cc(ccc1NC2c1ccccc1F)C(=O)O

STK762426
Synonyms: 2-(1,3-benzodioxol-5-yl)-4-(naphthalen-1-yl)-5-phenyl-1H-imidazole
Smiles: c1ccc(cc1)c1[nH]c(nc1c1cccc2c1cccc2)c1ccc2c(c1)OCO2

STK676326
Synonyms: 6-hydroxy-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-4-carboxylicacid
Smiles: OC(=O)C1Nc2c(O)cccc2C2C1CC=C2

STK762428
Synonyms: 8-chloro-4-(cyclohex-3-en-1-yl)-9-nitro-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinolin-6-ol
Smiles: Oc1cc(Cl)c(c2c1NC(C1CCC=CC1)C1C2C=CC1)[N+](=O)[O-]

STK676328
Synonyms: 7-(2-fluorophenyl)-3b,6,6a,7,9,9a,10,12a-octahydrocyclopenta[c]cyclopenta[4,5]pyrido[3,2,1-ij]quinoline-2-carboxylicacid
Smiles: OC(=O)c1cc2C3C=CCC3C(N3c2c(c1)C1C=CCC1C3)c1ccccc1F

STK676330
Synonyms: 1-[(4-phenylpiperazin-1-yl)methyl]-3'-[3-(trifluoromethyl)phenyl]-4'H-spiro[indole-3,2'-[1,3]thiazolidine]-2,4'(1H)-dione
Smiles: O=C1CSC2(N1c1cccc(c1)C(F)(F)F)C(=O)N(c1c2cccc1)CN1CCN(CC1)c1ccccc1

STK762430
Synonyms: [2-amino-1-(4-phenyl-1,3-thiazol-2-yl)indolizin-3-yl](phenyl)methanone
Smiles: O=C(c1n2ccccc2c(c1N)c1scc(n1)c1ccccc1)c1ccccc1

STK762432
Synonyms: (2E)-2-(hydroxyimino)-N'-[(3Z)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]ethanehydrazide
Smiles: O/N=C/C(=O)N/N=C/1\C(=O)Nc2c1cccc2

STK676331
Synonyms: 2-[(3,4-dimethoxybenzyl)sulfanyl]-3-phenylquinazolin-4(3H)-one
Smiles: COc1ccc(cc1OC)CSc1nc2ccccc2c(=O)n1c1ccccc1

STK762444
Synonyms: (3Z)-3-[2-(5-methylfuran-2-yl)-2-oxoethylidene]-3,4-dihydroquinoxalin-2(1H)-one
Smiles: Cc1ccc(o1)C(=O)/C=c/1\[nH]c2ccccc2[nH]c1=O

STK762461
Synonyms: ethyl3-amino-1-(1,3-benzodioxol-5-yl)-1H-benzo[f]chromene-2-carboxylate
Smiles: CCOC(=O)C1=C(N)Oc2c(C1c1ccc3c(c1)OCO3)c1ccccc1cc2

STK762462
Synonyms: (2E)-2-[(3-phenylbicyclo[2.2.1]hepta-2,5-dien-2-yl)methylidene]hydrazinecarbothioamide
Smiles: NC(=S)N/N=C/C1=C(C2CC1C=C2)c1ccccc1

STK676343
Synonyms: 4-[(pyridin-3-ylmethyl)amino]-1-oxaspiro[4.5]dec-3-en-2-one
Smiles: O=C1C=C(C2(O1)CCCCC2)NCc1cccnc1

STK676352
Synonyms: 6-{3-hydroxy-5-(4-methylphenyl)-4-[(4-methylphenyl)carbonyl]-2-oxo-2,5-dihydro-1H-pyrrol-1-yl}hexanoicacid
Smiles: OC(=O)CCCCCN1C(c2ccc(cc2)C)C(=C(C1=O)O)C(=O)c1ccc(cc1)C

STK676359
Synonyms: 4-[(2-hydroxyethyl)(methyl)amino]-1-oxaspiro[4.5]dec-3-en-2-one
Smiles: OCCN(C1=CC(=O)OC21CCCCC2)C

STK762496
Synonyms: 3-{[2-(4-chlorophenyl)-1,3-thiazolidin-3-yl]carbonyl}-2H-chromen-2-one
Smiles: Clc1ccc(cc1)C1SCCN1C(=O)c1cc2ccccc2oc1=O

STK762498
Synonyms: (3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazol-5-yl)(3-methyl-1H-pyrazol-1-yl)methanone
Smiles: Cc1ccn(n1)C(=O)c1cc2c(s1)n(nc2C)c1ccccc1

STK762501
Synonyms: propan-2-yl3-methyl-1-phenyl-1H-thieno[2,3-c]pyrazole-5-carboxylate
Smiles: CC(OC(=O)c1cc2c(s1)n(nc2C)c1ccccc1)C

STK676361
Synonyms: N-[(3-cyano-1-methyl-1H-indol-2-yl)methyl]-2-(morpholin-4-yl)-N-phenylacetamide
Smiles: N#Cc1c(CN(c2ccccc2)C(=O)CN2CCOCC2)n(c2c1cccc2)C

STK676362
Synonyms: 4-[4-(2-hydroxyethyl)piperazin-1-yl]-1-oxaspiro[4.5]dec-3-en-2-one
Smiles: OCCN1CCN(CC1)C1=CC(=O)OC21CCCCC2

STK676366
Synonyms: (4E)-2-(4-bromophenyl)-4-{[(5-ethyl-1,3,4-thiadiazol-2-yl)amino]methylidene}-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: CCc1nnc(s1)N/C=C/1\C(=NN(C1=O)c1ccc(cc1)Br)C

STK762514
Synonyms: 3-hydroxy-4-[(4-methoxyphenyl)carbonyl]-1-(pyridin-2-yl)-5-(pyridin-3-yl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: COc1ccc(cc1)C(=O)C1=C(O)C(=O)N(C1c1cccnc1)c1ccccn1

STK762518
Synonyms: 4-(6-amino-5-cyano-3-methyl-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)-2-methoxyphenylmorpholine-4-carboxylate
Smiles: N#CC1=C(N)Oc2c(C1c1ccc(c(c1)OC)OC(=O)N1CCOCC1)c(C)n[nH]2

STK676374
Synonyms: ethylN-(6-ethoxy-1,3-benzothiazol-2-yl)-3,3,3-trifluoro-2-(propanoylamino)alaninate
Smiles: CCOc1ccc2c(c1)sc(n2)NC(C(F)(F)F)(C(=O)OCC)NC(=O)CC

STK762524
Synonyms: 1-[1-(4-bromophenyl)-6,8-diphenyl-4-thia-1,2,6,7-tetraazaspiro[4.5]deca-2,7-dien-3-yl]ethanone
Smiles: Brc1ccc(cc1)N1N=C(SC21CCC(=NN2c1ccccc1)c1ccccc1)C(=O)C

STK762530
Synonyms: N'-{(Z)-[1-(2,6-dichlorobenzyl)-3-phenyl-1H-pyrazol-4-yl]methylidene}-2-methylfuran-3-carbohydrazide
Smiles: Clc1cccc(c1Cn1nc(c(c1)/C=N\NC(=O)c1ccoc1C)c1ccccc1)Cl

STK676376
Synonyms: N'-{(E)-[3-(3,4-dihydroquinolin-1(2H)-ylmethyl)-4-methoxyphenyl]methylidene}-4-iodo-1-methyl-1H-pyrazole-3-carbohydrazide
Smiles: COc1ccc(cc1CN1CCCc2c1cccc2)/C=N/NC(=O)c1nn(cc1I)C

STK762531
Synonyms: 2-chloro-4-nitro-N-[4-(piperidin-1-ylcarbonyl)phenyl]benzamide
Smiles: O=C(c1ccc(cc1Cl)[N+](=O)[O-])Nc1ccc(cc1)C(=O)N1CCCCC1

STK676377
Synonyms: 2-oxo-2-{[4-(trifluoromethoxy)phenyl]amino}ethyl2-methylfuran-3-carboxylate
Smiles: O=C(Nc1ccc(cc1)OC(F)(F)F)COC(=O)c1ccoc1C

STK676379
Synonyms: 3',5'-diphenyl-3H,3'H-spiro[1,3-benzothiazole-2,2'-[1,3,4]thiadiazole]
Smiles: c1ccc(cc1)C1=NN(C2(S1)Sc1c(N2)cccc1)c1ccccc1

STK762535
Synonyms: 3-methyl-5-oxo-4-propylcyclohexane-1,1,2,2-tetracarbonitrile
Smiles: CCCC1C(=O)CC(C(C1C)(C#N)C#N)(C#N)C#N

STK762561
Synonyms: 8-(4-methylphenyl)-8,10,11,12-tetrahydrobenzo[a][4,7]phenanthrolin-9(7H)-one
Smiles: Cc1ccc(cc1)C1Nc2ccc3c(c2C2=C1C(=O)CCC2)cccn3

STK676387
Synonyms: 2-(benzylsulfonyl)-4,6-dimethoxybenzonitrile
Smiles: COc1cc(OC)c(c(c1)S(=O)(=O)Cc1ccccc1)C#N

STK676389
Synonyms: (2E,4E)-5-(furan-2-yl)penta-2,4-dienoicacid
Smiles: OC(=O)/C=C/C=C/c1ccco1

STK762564
Synonyms: 3-(4-amino-1,2,5-oxadiazol-3-yl)-1,2,4-oxadiazol-5-amine
Smiles: Nc1onc(n1)c1nonc1N

STK762566
Synonyms: 4,4'-(propane-2,2-diyldisulfanediyl)bis(2,6-di-tert-butylphenol)
Smiles: CC(Sc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)(Sc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)C

STK676391
Synonyms: 6-amino-2-bromo-3-methylbenzoicacid
Smiles: OC(=O)c1c(N)ccc(c1Br)C

STK676392
Synonyms: methyl2,3,4-tri-O-acetyl-6-O-tritylhexopyranoside
Smiles: COC1OC(COC(c2ccccc2)(c2ccccc2)c2ccccc2)C(C(C1OC(=O)C)OC(=O)C)OC(=O)C

STK762568
Synonyms: 6,8-dioxabicyclo[3.2.1]octane-2,3,4-triyltriacetate(non-preferredname)
Smiles: CC(=O)OC1C(OC(=O)C)C2COC(C1OC(=O)C)O2

STK676393
Synonyms: methyl4,6-bis-O-[(4-methylphenyl)sulfonyl]-2,3-bis-O-(phenoxycarbonyl)hexopyranoside
Smiles: COC1OC(COS(=O)(=O)c2ccc(cc2)C)C(C(C1OC(=O)Oc1ccccc1)OC(=O)Oc1ccccc1)OS(=O)(=O)c1ccc(cc1)C

STK676397
Synonyms: 3-(dodecylsulfanyl)propanoicacid
Smiles: CCCCCCCCCCCCSCCC(=O)O

STK676398
Synonyms: 5-(octylsulfanyl)pentanoicacid
Smiles: CCCCCCCCSCCCCC(=O)O

STK762569
Synonyms: 2,2'-sulfinyldiethanol
Smiles: OCCS(=O)CCO

STK676399
Synonyms: 1-[(2-chloroethyl)sulfonyl]octane
Smiles: CCCCCCCCS(=O)(=O)CCCl

STK762570
Synonyms: 4-[(2-amino-4-methyl-1,3-thiazol-5-yl)methyl]phenol
Smiles: Oc1ccc(cc1)Cc1sc(nc1C)N

STK762571
Synonyms: 3,3-bis(4-methylphenyl)-2-benzofuran-1(3H)-one
Smiles: Cc1ccc(cc1)C1(OC(=O)c2c1cccc2)c1ccc(cc1)C

STK676401
Synonyms: ethene-1,1-diylbis(phosphonicacid)
Smiles: C=C(P(=O)(O)O)P(=O)(O)O

STK762572
Synonyms: methyl2H-tetrazol-2-ylacetate
Smiles: COC(=O)Cn1nncn1

STK676405
Synonyms: 2-amino-6-chlorobenzoicacid
Smiles: OC(=O)c1c(N)cccc1Cl

STK676406
Synonyms: 2-(acetylamino)-6-chlorobenzoicacid
Smiles: CC(=O)Nc1cccc(c1C(=O)O)Cl

STK676407
Synonyms: ethyl2-amino-5-ethyl-4-phenylthiophene-3-carboxylate
Smiles: CCOC(=O)c1c(N)sc(c1c1ccccc1)CC

STK762592
Synonyms: 4,4-dihydroxy-2-(4-methoxyphenyl)-5-[(4-methylphenyl)carbonyl]-2,4-dihydro-3H-pyrazol-3-one
Smiles: COc1ccc(cc1)N1N=C(C(C1=O)(O)O)C(=O)c1ccc(cc1)C

STK676410
Synonyms: methyl6-tert-butyl-2-({[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c(NC(=O)CSc2nncn2C)sc2c1CCC(C2)C(C)(C)C

STK676412
Synonyms: 3-chloro-2-oxo-N-phenylpropanamide
Smiles: ClCC(=O)C(=O)Nc1ccccc1

STK762624
Synonyms: 2-amino-1-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-6-methyl-4,4-bis(trifluoromethyl)-1,4-dihydropyridine-3-carbonitrile
Smiles: N#Cc1c(sc2c1CCCC2)N1C(=CC(C(=C1N)C#N)(C(F)(F)F)C(F)(F)F)C

STK676420
Synonyms: 1,8-bis(2,3,5,6-tetrafluoropyridin-4-yl)-1,4,8,11-tetraazacyclotetradecane-5,12-dione
Smiles: O=C1NCCN(CCC(=O)NCCN(CC1)c1c(F)c(F)nc(c1F)F)c1c(F)c(F)nc(c1F)F

STK676422
Synonyms: 4-acetyl-3-hydroxy-5-(3-nitrophenyl)-1-[2-(piperazin-1-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
Smiles: CC(=O)C1=C(O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])CCN1CCNCC1

STK762637
Synonyms: 2-[2-(4-amino-1,2,5-oxadiazol-3-yl)-1H-benzimidazol-1-yl]-1-(morpholin-4-yl)ethanone
Smiles: O=C(N1CCOCC1)Cn1c(nc2c1cccc2)c1nonc1N

STK762638
Synonyms: 2-amino-5-(propan-2-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7(3H)-one
Smiles: CC(c1cc(=O)n2c(n1)[nH]c(n2)N)C

STK676431
Synonyms: 6-(4-benzylpiperazin-1-yl)-N-(2-fluorophenyl)[1,2,5]oxadiazolo[3,4-b]pyrazin-5-amine
Smiles: Fc1ccccc1Nc1nc2nonc2nc1N1CCN(CC1)Cc1ccccc1

STK676433
Synonyms: N-cyclopentyl-6-(morpholin-4-yl)-N'-(propan-2-yl)-1,3,5-triazine-2,4-diamine
Smiles: CC(Nc1nc(NC2CCCC2)nc(n1)N1CCOCC1)C

STK676434
Synonyms: 4,4,6a,6b-tetramethyl-3-(4-methylphenyl)hexahydro-3H-1-oxa-2a,3-diazacyclopenta[cd]pentalen-2-one
Smiles: Cc1ccc(cc1)N1N2C(=O)OC3(C2(C(C1(C)C)CC3)C)C

STK676435
Synonyms: N-[2-(4,5-dihydro-1,3-thiazol-2-ylamino)-1,1,1,3,3,3-hexafluoropropan-2-yl]furan-2-carboxamide
Smiles: O=C(c1ccco1)NC(C(F)(F)F)(C(F)(F)F)NC1=NCCS1

STK676438
Synonyms: N-(3,4-dimethylphenyl)-N'-(propan-2-yl)[1,2,5]oxadiazolo[3,4-b]pyrazine-5,6-diamine
Smiles: CC(Nc1nc2nonc2nc1Nc1ccc(c(c1)C)C)C

STK676440
Synonyms: ethyl6-amino-4-(3-iodophenyl)-3-propyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carboxylate
Smiles: CCOC(=O)C1=C(N)Oc2c(C1c1cccc(c1)I)c(CCC)n[nH]2

STK676441
Synonyms: 5-[4-(5-amino-1,3,4-thiadiazol-2-yl)phenyl]-2,2-dimethyl-2,3,5,6-tetrahydrobenzo[a]phenanthridin-4(1H)-one
Smiles: Nc1nnc(s1)c1ccc(cc1)C1Nc2ccc3c(c2C2=C1C(=O)CC(C2)(C)C)cccc3

STK762668
Synonyms: 2-(2-amino-1,3-thiazol-4-yl)-N'-[(3E)-2-oxo-1-(prop-2-en-1-yl)-1,2-dihydro-3H-indol-3-ylidene]acetohydrazide
Smiles: C=CCN1C(=O)/C(=N/NC(=O)Cc2csc(n2)N)/c2c1cccc2

STK762669
Synonyms: 2,4,7-trimethylbenzo[b][1,8]naphthyridin-5(10H)-one
Smiles: Cc1ccc2c(c1)c(=O)c1c([nH]2)nc(cc1C)C

STK676450
Synonyms: 4-{2-[(2-oxo-1-oxaspiro[4.5]dec-3-en-4-yl)amino]ethyl}benzenesulfonamide
Smiles: O=C1C=C(C2(O1)CCCCC2)NCCc1ccc(cc1)S(=O)(=O)N

STK762676
Synonyms: tert-butyl4-(4-chlorophenyl)-5-cyano-2-methyl-6-[(naphthalen-1-ylmethyl)sulfanyl]-1,4-dihydropyridine-3-carboxylate
Smiles: N#CC1=C(SCc2cccc3c2cccc3)NC(=C(C1c1ccc(cc1)Cl)C(=O)OC(C)(C)C)C

STK762680
Synonyms: tert-butyl6-({2-[(3-chloro-4-methylphenyl)amino]-2-oxoethyl}sulfanyl)-4-(4-chlorophenyl)-5-cyano-2-methyl-1,4-dihydropyridine-3-carboxylate
Smiles: N#CC1=C(SCC(=O)Nc2ccc(c(c2)Cl)C)NC(=C(C1c1ccc(cc1)Cl)C(=O)OC(C)(C)C)C

STK762681
Synonyms: 2-{[5-acetyl-4-(2-chlorophenyl)-3-cyano-6-methyl-1,4-dihydropyridin-2-yl]sulfanyl}-N-(2,4-dimethylphenyl)acetamide
Smiles: N#CC1=C(SCC(=O)Nc2ccc(cc2C)C)NC(=C(C1c1ccccc1Cl)C(=O)C)C

STK762682
Synonyms: tert-butyl4-(4-chlorophenyl)-5-cyano-2-methyl-6-({2-[(2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-1,4-dihydropyridine-3-carboxylate
Smiles: N#CC1=C(SCC(=O)Nc2ccccc2C)NC(=C(C1c1ccc(cc1)Cl)C(=O)OC(C)(C)C)C