Product OPENEYE NAME: 3-(4-chlorophenyl)-2-(3-methylsulfanyl-6,7-dihydro-2-benzothiophene-1-carbonyl)prop-2-enenitrile
CAS Name: 3-(4-chlorophenyl)-2-[[3-(methylthio)-6,7-dihydro-2-benzothiophen-1-yl]-oxomethyl]-2-propenenitrile
IUPAC NAME: 3-(4-chlorophenyl)-2-(3-methylsulfanyl-6,7-dihydro-2-benzothiophene-1-carbonyl)prop-2-enenitrile
SYSTEMATIC NAME: 3-(4-chlorophenyl)-2-[(3-methylsulfanyl-6,7-dihydro-2-benzothiophen-1-yl)carbonyl]prop-2-enenitrile
MOLECULAR FORMULA: C19H14ClNOS2
MOLECULAR WEIGHT: 371.90356
SMILES: CSC1=C2C=CCCC2=C(S1)C(=O)C(=CC3=CC=C(C=C3)Cl)C#N
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Product OPENEYE NAME: methyl 3-[2-(4-chlorobenzoyl)oxyethylsulfanyl]-6,6-dimethyl-4-oxo-5,7-dihydro-2-benzothiophene-1-carboxylate
CAS Name: 3-[2-[(4-chlorophenyl)-oxomethoxy]ethylthio]-6,6-dimethyl-4-oxo-5,7-dihydro-2-benzothiophene-1-carboxylic acid methyl ester
IUPAC NAME: methyl 3-[2-(4-chlorobenzoyl)oxyethylsulfanyl]-6,6-dimethyl-4-oxo-5,7-dihydro-2-benzothiophene-1-carboxylate
SYSTEMATIC NAME: methyl 3-[2-(4-chlorophenyl)carbonyloxyethylsulfanyl]-6,6-dimethyl-4-oxidanylidene-5,7-dihydro-2-benzothiophene-1-carboxylate
MOLECULAR FORMULA: C21H21ClO5S2
MOLECULAR WEIGHT: 452.97144
SMILES: CC1(CC2=C(SC(=C2C(=O)C1)SCCOC(=O)C3=CC=C(C=C3)Cl)C(=O)OC)C
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Product OPENEYE NAME: methyl 6,6-dimethyl-4-oxo-3-[2-[3-(trifluoromethyl)benzoyl]oxyethylsulfanyl]-5,7-dihydro-2-benzothiophene-1-carboxylate
CAS Name: 6,6-dimethyl-4-oxo-3-[2-[oxo-[3-(trifluoromethyl)phenyl]methoxy]ethylthio]-5,7-dihydro-2-benzothiophene-1-carboxylic acid methyl ester
IUPAC NAME: methyl 6,6-dimethyl-4-oxo-3-[2-[3-(trifluoromethyl)benzoyl]oxyethylsulfanyl]-5,7-dihydro-2-benzothiophene-1-carboxylate
SYSTEMATIC NAME: methyl 6,6-dimethyl-4-oxidanylidene-3-[2-[3-(trifluoromethyl)phenyl]carbonyloxyethylsulfanyl]-5,7-dihydro-2-benzothiophene-1-carboxylate
MOLECULAR FORMULA: C22H21F3O5S2
MOLECULAR WEIGHT: 486.52435
SMILES: CC1(CC2=C(SC(=C2C(=O)C1)SCCOC(=O)C3=CC(=CC=C3)C(F)(F)F)C(=O)OC)C
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Product OPENEYE NAME: (Z)-2-amino-3-[(2,2-dimethylchroman-6-yl)methyleneamino]but-2-enedinitrile
CAS Name: (Z)-2-amino-3-[(2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-yl)methylideneamino]-2-butenedinitrile
IUPAC NAME: (Z)-2-amino-3-[(2,2-dimethyl-3,4-dihydrochromen-6-yl)methylideneamino]but-2-enedinitrile
SYSTEMATIC NAME: (Z)-2-azanyl-3-[(2,2-dimethyl-3,4-dihydrochromen-6-yl)methylideneamino]but-2-enedinitrile
MOLECULAR FORMULA: C16H16N4O
MOLECULAR WEIGHT: 280.32444
SMILES: CC1(CCC2=C(O1)C=CC(=C2)C=N/C(=C(/C#N)\N)/C#N)C
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Product OPENEYE NAME: 5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carbothioamide
CAS Name: 5,7-bis(trifluoromethyl)-3-pyrazolo[1,5-a]pyrimidinecarbothioamide
IUPAC NAME: 5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carbothioamide
SYSTEMATIC NAME: 5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carbothioamide
MOLECULAR FORMULA: C9H4F6N4S
MOLECULAR WEIGHT: 314.210279
SMILES: C1=C(N2C(=C(C=N2)C(=S)N)N=C1C(F)(F)F)C(F)(F)F
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Product OPENEYE NAME: methyl 6,6-dimethyl-4-oxo-3-[2-[[4-(trifluoromethoxy)phenyl]carbamoyloxy]ethylsulfanyl]-5,7-dihydro-2-benzothiophene-1-carboxylate
CAS Name: 6,6-dimethyl-4-oxo-3-[2-[oxo-[4-(trifluoromethoxy)anilino]methoxy]ethylthio]-5,7-dihydro-2-benzothiophene-1-carboxylic acid methyl ester
IUPAC NAME: methyl 6,6-dimethyl-4-oxo-3-[2-[[4-(trifluoromethoxy)phenyl]carbamoyloxy]ethylsulfanyl]-5,7-dihydro-2-benzothiophene-1-carboxylate
SYSTEMATIC NAME: methyl 6,6-dimethyl-4-oxidanylidene-3-[2-[[4-(trifluoromethyloxy)phenyl]carbamoyloxy]ethylsulfanyl]-5,7-dihydro-2-benzothiophene-1-carboxylate
MOLECULAR FORMULA: C22H22F3NO6S2
MOLECULAR WEIGHT: 517.53839
SMILES: CC1(CC2=C(SC(=C2C(=O)C1)SCCOC(=O)NC3=CC=C(C=C3)OC(F)(F)F)C(=O)OC)C
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Product OPENEYE NAME: ethyl 3-cyano-6,6-dimethyl-4-oxo-5,7-dihydro-2-benzothiophene-1-carboxylate
CAS Name: 3-cyano-6,6-dimethyl-4-oxo-5,7-dihydro-2-benzothiophene-1-carboxylic acid ethyl ester
IUPAC NAME: ethyl 3-cyano-6,6-dimethyl-4-oxo-5,7-dihydro-2-benzothiophene-1-carboxylate
SYSTEMATIC NAME: ethyl 3-cyano-6,6-dimethyl-4-oxidanylidene-5,7-dihydro-2-benzothiophene-1-carboxylate
MOLECULAR FORMULA: C14H15NO3S
MOLECULAR WEIGHT: 277.3388
SMILES: CCOC(=O)C1=C2CC(CC(=O)C2=C(S1)C#N)(C)C
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Product OPENEYE NAME: bis(3,5-dichlorophenyl) 5-chlorothiophene-2,4-disulfonate
CAS Name: 5-chlorothiophene-2,4-disulfonic acid bis(3,5-dichlorophenyl) ester
IUPAC NAME: bis(3,5-dichlorophenyl) 5-chlorothiophene-2,4-disulfonate
SYSTEMATIC NAME: bis[3,5-bis(chloranyl)phenyl] 5-chloranylthiophene-2,4-disulfonate
MOLECULAR FORMULA: C16H7Cl5O6S3
MOLECULAR WEIGHT: 568.68318
SMILES: C1=C(C=C(C=C1Cl)Cl)OS(=O)(=O)C2=CC(=C(S2)Cl)S(=O)(=O)OC3=CC(=CC(=C3)Cl)Cl
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Product OPENEYE NAME: bis(4-methoxyphenyl) 5-chlorothiophene-2,4-disulfonate
CAS Name: 5-chlorothiophene-2,4-disulfonic acid bis(4-methoxyphenyl) ester
IUPAC NAME: bis(4-methoxyphenyl) 5-chlorothiophene-2,4-disulfonate
SYSTEMATIC NAME: bis(4-methoxyphenyl) 5-chloranylthiophene-2,4-disulfonate
MOLECULAR FORMULA: C18H15ClO8S3
MOLECULAR WEIGHT: 490.9549
SMILES: COC1=CC=C(C=C1)OS(=O)(=O)C2=CC(=C(S2)Cl)S(=O)(=O)OC3=CC=C(C=C3)OC
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Product OPENEYE NAME: ethyl 3-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-4-oxo-6,7-dihydro-5H-2-benzothiophene-1-carboxylate
CAS Name: 3-[2-(4-chlorophenyl)sulfonylethylthio]-4-oxo-6,7-dihydro-5H-2-benzothiophene-1-carboxylic acid ethyl ester
IUPAC NAME: ethyl 3-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-4-oxo-6,7-dihydro-5H-2-benzothiophene-1-carboxylate
SYSTEMATIC NAME: ethyl 3-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-4-oxidanylidene-6,7-dihydro-5H-2-benzothiophene-1-carboxylate
MOLECULAR FORMULA: C19H19ClO5S3
MOLECULAR WEIGHT: 458.99916
SMILES: CCOC(=O)C1=C2CCCC(=O)C2=C(S1)SCCS(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: (2Z)-2-[(4-chloroanilino)methylene]-4-phenyl-cyclohexane-1,3-dione
CAS Name: (2Z)-2-[(4-chloroanilino)methylidene]-4-phenylcyclohexane-1,3-dione
IUPAC NAME: (2Z)-2-[(4-chloroanilino)methylidene]-4-phenylcyclohexane-1,3-dione
SYSTEMATIC NAME: (2Z)-2-[[(4-chlorophenyl)amino]methylidene]-4-phenyl-cyclohexane-1,3-dione
MOLECULAR FORMULA: C19H16ClNO2
MOLECULAR WEIGHT: 325.78884
SMILES: C1CC(=O)/C(=C/NC2=CC=C(C=C2)Cl)/C(=O)C1C3=CC=CC=C3
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Product OPENEYE NAME: 6-(1,3-dithiolan-2-yl)-2,2-dimethyl-chromane
CAS Name: 6-(1,3-dithiolan-2-yl)-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran
IUPAC NAME: 6-(1,3-dithiolan-2-yl)-2,2-dimethyl-3,4-dihydrochromene
SYSTEMATIC NAME: 6-(1,3-dithiolan-2-yl)-2,2-dimethyl-3,4-dihydrochromene
MOLECULAR FORMULA: C14H18OS2
MOLECULAR WEIGHT: 266.42212
SMILES: CC1(CCC2=C(O1)C=CC(=C2)C3SCCS3)C
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Product OPENEYE NAME: 2-[5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]-4-(4-chlorophenyl)thiazole
CAS Name: 2-[5,7-bis(trifluoromethyl)-3-pyrazolo[1,5-a]pyrimidinyl]-4-(4-chlorophenyl)thiazole
IUPAC NAME: 2-[5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]-4-(4-chlorophenyl)-1,3-thiazole
SYSTEMATIC NAME: 2-[5,7-bis(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]-4-(4-chlorophenyl)-1,3-thiazole
MOLECULAR FORMULA: C17H7ClF6N4S
MOLECULAR WEIGHT: 448.772699
SMILES: C1=CC(=CC=C1C2=CSC(=N2)C3=C4N=C(C=C(N4N=C3)C(F)(F)F)C(F)(F)F)Cl
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Product OPENEYE NAME: 2-[(3-acetyl-5,5-dimethyl-7-oxo-4,6-dihydro-2-benzothiophen-1-yl)sulfanyl]ethyl 4-chlorobenzenesulfonate
CAS Name: 4-chlorobenzenesulfonic acid 2-[(3-acetyl-5,5-dimethyl-7-oxo-4,6-dihydro-2-benzothiophen-1-yl)thio]ethyl ester
IUPAC NAME: 2-[(3-acetyl-5,5-dimethyl-7-oxo-4,6-dihydro-2-benzothiophen-1-yl)sulfanyl]ethyl 4-chlorobenzenesulfonate
SYSTEMATIC NAME: 2-[(3-ethanoyl-5,5-dimethyl-7-oxidanylidene-4,6-dihydro-2-benzothiophen-1-yl)sulfanyl]ethyl 4-chloranylbenzenesulfonate
MOLECULAR FORMULA: C20H21ClO5S3
MOLECULAR WEIGHT: 473.02574
SMILES: CC(=O)C1=C2CC(CC(=O)C2=C(S1)SCCOS(=O)(=O)C3=CC=C(C=C3)Cl)(C)C
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Product OPENEYE NAME: (2E)-2-[(4-methoxyanilino)methylene]-4-phenyl-cyclohexane-1,3-dione
CAS Name: (2E)-2-[(4-methoxyanilino)methylidene]-4-phenylcyclohexane-1,3-dione
IUPAC NAME: (2E)-2-[(4-methoxyanilino)methylidene]-4-phenylcyclohexane-1,3-dione
SYSTEMATIC NAME: (2E)-2-[[(4-methoxyphenyl)amino]methylidene]-4-phenyl-cyclohexane-1,3-dione
MOLECULAR FORMULA: C20H19NO3
MOLECULAR WEIGHT: 321.36976
SMILES: COC1=CC=C(C=C1)N/C=C/2\C(=O)CCC(C2=O)C3=CC=CC=C3
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Product OPENEYE NAME: (2E)-4-phenyl-2-[[3-(trifluoromethyl)anilino]methylene]cyclohexane-1,3-dione
CAS Name: (2E)-4-phenyl-2-[[3-(trifluoromethyl)anilino]methylidene]cyclohexane-1,3-dione
IUPAC NAME: (2E)-4-phenyl-2-[[3-(trifluoromethyl)anilino]methylidene]cyclohexane-1,3-dione
SYSTEMATIC NAME: (2E)-4-phenyl-2-[[[3-(trifluoromethyl)phenyl]amino]methylidene]cyclohexane-1,3-dione
MOLECULAR FORMULA: C20H16F3NO2
MOLECULAR WEIGHT: 359.34175
SMILES: C1CC(=O)/C(=C\NC2=CC=CC(=C2)C(F)(F)F)/C(=O)C1C3=CC=CC=C3
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Product OPENEYE NAME: (2Z)-2-[(2-chloroanilino)methylene]-4-phenyl-cyclohexane-1,3-dione
CAS Name: (2Z)-2-[(2-chloroanilino)methylidene]-4-phenylcyclohexane-1,3-dione
IUPAC NAME: (2Z)-2-[(2-chloroanilino)methylidene]-4-phenylcyclohexane-1,3-dione
SYSTEMATIC NAME: (2Z)-2-[[(2-chlorophenyl)amino]methylidene]-4-phenyl-cyclohexane-1,3-dione
MOLECULAR FORMULA: C19H16ClNO2
MOLECULAR WEIGHT: 325.78884
SMILES: C1CC(=O)/C(=C/NC2=CC=CC=C2Cl)/C(=O)C1C3=CC=CC=C3
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Product OPENEYE NAME: methyl 3-[[(E)-(2,6-dioxo-3-phenyl-cyclohexylidene)methyl]amino]thiophene-2-carboxylate
CAS Name: 3-[[(E)-(2,6-dioxo-3-phenylcyclohexylidene)methyl]amino]-2-thiophenecarboxylic acid methyl ester
IUPAC NAME: methyl 3-[[(E)-(2,6-dioxo-3-phenylcyclohexylidene)methyl]amino]thiophene-2-carboxylate
SYSTEMATIC NAME: methyl 3-[[(E)-[2,6-bis(oxidanylidene)-3-phenyl-cyclohexylidene]methyl]amino]thiophene-2-carboxylate
MOLECULAR FORMULA: C19H17NO4S
MOLECULAR WEIGHT: 355.40758
SMILES: COC(=O)C1=C(C=CS1)N/C=C/2\C(=O)CCC(C2=O)C3=CC=CC=C3
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Product OPENEYE NAME: ethyl 2-[[(E)-(2,6-dioxo-3-phenyl-cyclohexylidene)methyl]amino]-4,5-dimethyl-thiophene-3-carboxylate
CAS Name: 2-[[(E)-(2,6-dioxo-3-phenylcyclohexylidene)methyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester
IUPAC NAME: ethyl 2-[[(E)-(2,6-dioxo-3-phenylcyclohexylidene)methyl]amino]-4,5-dimethylthiophene-3-carboxylate
SYSTEMATIC NAME: ethyl 2-[[(E)-[2,6-bis(oxidanylidene)-3-phenyl-cyclohexylidene]methyl]amino]-4,5-dimethyl-thiophene-3-carboxylate
MOLECULAR FORMULA: C22H23NO4S
MOLECULAR WEIGHT: 397.48732
SMILES: CCOC(=O)C1=C(SC(=C1C)C)N/C=C/2\C(=O)CCC(C2=O)C3=CC=CC=C3
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Product OPENEYE NAME: 4-chloro-N-[(2,2-dimethylchroman-6-yl)methyleneamino]benzamide
CAS Name: 4-chloro-N-[(2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-yl)methylideneamino]benzamide
IUPAC NAME: 4-chloro-N-[(2,2-dimethyl-3,4-dihydrochromen-6-yl)methylideneamino]benzamide
SYSTEMATIC NAME: 4-chloranyl-N-[(2,2-dimethyl-3,4-dihydrochromen-6-yl)methylideneamino]benzamide
MOLECULAR FORMULA: C19H19ClN2O2
MOLECULAR WEIGHT: 342.81936
SMILES: CC1(CCC2=C(O1)C=CC(=C2)C=NNC(=O)C3=CC=C(C=C3)Cl)C
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Product OPENEYE NAME: 2,3-dichloro-N-[(2,2-dimethylchroman-6-yl)methyleneamino]benzamide
CAS Name: 2,3-dichloro-N-[(2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-yl)methylideneamino]benzamide
IUPAC NAME: 2,3-dichloro-N-[(2,2-dimethyl-3,4-dihydrochromen-6-yl)methylideneamino]benzamide
SYSTEMATIC NAME: 2,3-bis(chloranyl)-N-[(2,2-dimethyl-3,4-dihydrochromen-6-yl)methylideneamino]benzamide
MOLECULAR FORMULA: C19H18Cl2N2O2
MOLECULAR WEIGHT: 377.26442
SMILES: CC1(CCC2=C(O1)C=CC(=C2)C=NNC(=O)C3=C(C(=CC=C3)Cl)Cl)C
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