All Chemical Compounds

Monday, April 1, 2013

All Chemical Compounds Information

Product OPENEYE NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(2-phenylethyl)acetamide
CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-N-(2-phenylethyl)acetamide
IUPAC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(2-phenylethyl)acetamide
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(2-phenylethyl)ethanamide
MOLECULAR FORMULA: C20H24ClN3O3S
MOLECULAR WEIGHT: 421.94086
SMILES: C1CN(CCN1CC(=O)NCCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: methyl 6-[[(3,5-dimethoxybenzoyl)amino]carbamothioylamino]hexanoate
CAS Name: 6-[[[[(3,5-dimethoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]amino]hexanoic acid methyl ester
IUPAC NAME: methyl 6-[[(3,5-dimethoxybenzoyl)amino]carbamothioylamino]hexanoate
SYSTEMATIC NAME: methyl 6-[[(3,5-dimethoxyphenyl)carbonylamino]carbamothioylamino]hexanoate
MOLECULAR FORMULA: C17H25N3O5S
MOLECULAR WEIGHT: 383.4625
SMILES: COC1=CC(=CC(=C1)C(=O)NNC(=S)NCCCCCC(=O)OC)OC
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Product OPENEYE NAME: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl-ethyl-[(3-fluorophenyl)methyl]ammonium
CAS Name: (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl-ethyl-[(3-fluorophenyl)methyl]ammonium
IUPAC NAME: (7,8-dimethyl-2-oxochromen-4-yl)methyl-ethyl-[(3-fluorophenyl)methyl]azanium
SYSTEMATIC NAME: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl-ethyl-[(3-fluorophenyl)methyl]azanium
MOLECULAR FORMULA: C21H23FNO2+
MOLECULAR WEIGHT: 340.411223
SMILES: CC[NH+](CC1=CC(=CC=C1)F)CC2=CC(=O)OC3=C2C=CC(=C3C)C
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Product OPENEYE NAME: 4-[[ethyl-[(3-fluorophenyl)methyl]amino]methyl]-7,8-dimethyl-chromen-2-one
CAS Name: 4-[[ethyl-[(3-fluorophenyl)methyl]amino]methyl]-7,8-dimethyl-1-benzopyran-2-one
IUPAC NAME: 4-[[ethyl-[(3-fluorophenyl)methyl]amino]methyl]-7,8-dimethylchromen-2-one
SYSTEMATIC NAME: 4-[[ethyl-[(3-fluorophenyl)methyl]amino]methyl]-7,8-dimethyl-chromen-2-one
MOLECULAR FORMULA: C21H22FNO2
MOLECULAR WEIGHT: 339.403283
SMILES: CCN(CC1=CC(=CC=C1)F)CC2=CC(=O)OC3=C2C=CC(=C3C)C
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Product OPENEYE NAME: [(1S)-1-methyl-2-oxo-2-(2-phenylanilino)ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [(2S)-1-oxo-1-(2-phenylanilino)propan-2-yl] ester
IUPAC NAME: [(2S)-1-oxo-1-(2-phenylanilino)propan-2-yl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [(2S)-1-oxidanylidene-1-[(2-phenylphenyl)amino]propan-2-yl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C25H21NO4
MOLECULAR WEIGHT: 399.43854
SMILES: C[C@@H](C(=O)NC1=CC=CC=C1C2=CC=CC=C2)OC(=O)C3=CC4=CC=CC=C4OC3
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Product OPENEYE NAME: 1-[(3,5-dimethoxybenzoyl)amino]-3-[(1R,2R)-2-methylcyclohexyl]thiourea
CAS Name: 1-[[(3,5-dimethoxyphenyl)-oxomethyl]amino]-3-[(1R,2R)-2-methylcyclohexyl]thiourea
IUPAC NAME: 1-[(3,5-dimethoxybenzoyl)amino]-3-[(1R,2R)-2-methylcyclohexyl]thiourea
SYSTEMATIC NAME: 1-[(3,5-dimethoxyphenyl)carbonylamino]-3-[(1R,2R)-2-methylcyclohexyl]thiourea
MOLECULAR FORMULA: C17H25N3O3S
MOLECULAR WEIGHT: 351.4637
SMILES: C[C@@H]1CCCC[C@H]1NC(=S)NNC(=O)C2=CC(=CC(=C2)OC)OC
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Product OPENEYE NAME: (E)-3-[4-(diethylsulfamoyl)phenyl]-N-(3,4-dimethylphenyl)prop-2-enamide
CAS Name: (E)-3-[4-(diethylsulfamoyl)phenyl]-N-(3,4-dimethylphenyl)-2-propenamide
IUPAC NAME: (E)-3-[4-(diethylsulfamoyl)phenyl]-N-(3,4-dimethylphenyl)prop-2-enamide
SYSTEMATIC NAME: (E)-3-[4-(diethylsulfamoyl)phenyl]-N-(3,4-dimethylphenyl)prop-2-enamide
MOLECULAR FORMULA: C21H26N2O3S
MOLECULAR WEIGHT: 386.50774
SMILES: CCN(CC)S(=O)(=O)C1=CC=C(C=C1)/C=C/C(=O)NC2=CC(=C(C=C2)C)C
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Product OPENEYE NAME: [5-(4-fluorophenyl)-4-methyl-isoxazol-3-yl]methyl 2-(2-chlorophenoxy)acetate
CAS Name: 2-(2-chlorophenoxy)acetic acid [5-(4-fluorophenyl)-4-methyl-3-isoxazolyl]methyl ester
IUPAC NAME: [5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methyl 2-(2-chlorophenoxy)acetate
SYSTEMATIC NAME: [5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methyl 2-(2-chloranylphenoxy)ethanoate
MOLECULAR FORMULA: C19H15ClFNO4
MOLECULAR WEIGHT: 375.778103
SMILES: CC1=C(ON=C1COC(=O)COC2=CC=CC=C2Cl)C3=CC=C(C=C3)F
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Product OPENEYE NAME: [(1R)-1-methyl-2-oxo-2-(2-phenylanilino)ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [(2R)-1-oxo-1-(2-phenylanilino)propan-2-yl] ester
IUPAC NAME: [(2R)-1-oxo-1-(2-phenylanilino)propan-2-yl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [(2R)-1-oxidanylidene-1-[(2-phenylphenyl)amino]propan-2-yl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C25H21NO4
MOLECULAR WEIGHT: 399.43854
SMILES: C[C@H](C(=O)NC1=CC=CC=C1C2=CC=CC=C2)OC(=O)C3=CC4=CC=CC=C4OC3
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Product OPENEYE NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-(4-methyl-1-piperidyl)ethanone
CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]-1-(4-methyl-1-piperidinyl)ethanone
IUPAC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-(4-methylpiperidin-1-yl)ethanone
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-(4-methylpiperidin-1-yl)ethanone
MOLECULAR FORMULA: C18H27ClN3O3S+
MOLECULAR WEIGHT: 400.94328
SMILES: CC1CCN(CC1)C(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-1-(4-methyl-1-piperidyl)ethanone
CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-1-(4-methyl-1-piperidinyl)ethanone
IUPAC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-1-(4-methylpiperidin-1-yl)ethanone
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-1-(4-methylpiperidin-1-yl)ethanone
MOLECULAR FORMULA: C18H26ClN3O3S
MOLECULAR WEIGHT: 399.93534
SMILES: CC1CCN(CC1)C(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 3-[(3,5-dimethylisoxazol-4-yl)methoxy]-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]benzamide
CAS Name: 3-[(3,5-dimethyl-4-isoxazolyl)methoxy]-N-[2-[(2-fluorophenyl)methylthio]ethyl]benzamide
IUPAC NAME: 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]benzamide
SYSTEMATIC NAME: 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]benzamide
MOLECULAR FORMULA: C22H23FN2O3S
MOLECULAR WEIGHT: 414.493023
SMILES: CC1=C(C(=NO1)C)COC2=CC=CC(=C2)C(=O)NCCSCC3=CC=CC=C3F
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Product OPENEYE NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(3-ethylphenyl)acetamide
CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-(3-ethylphenyl)acetamide
IUPAC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(3-ethylphenyl)acetamide
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(3-ethylphenyl)ethanamide
MOLECULAR FORMULA: C20H25ClN3O3S+
MOLECULAR WEIGHT: 422.9488
SMILES: CCC1=CC(=CC=C1)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(3-ethylphenyl)acetamide
CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-N-(3-ethylphenyl)acetamide
IUPAC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(3-ethylphenyl)acetamide
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(3-ethylphenyl)ethanamide
MOLECULAR FORMULA: C20H24ClN3O3S
MOLECULAR WEIGHT: 421.94086
SMILES: CCC1=CC(=CC=C1)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl
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All Chemical Compounds Information

Product OPENEYE NAME: [(1S)-2-(1,3-benzodioxol-5-ylamino)-1-methyl-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [(2S)-1-(1,3-benzodioxol-5-ylamino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(1,3-benzodioxol-5-ylamino)-1-oxopropan-2-yl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [(2S)-1-(1,3-benzodioxol-5-ylamino)-1-oxidanylidene-propan-2-yl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C20H17NO6
MOLECULAR WEIGHT: 367.35208
SMILES: C[C@@H](C(=O)NC1=CC2=C(C=C1)OCO2)OC(=O)C3=CC4=CC=CC=C4OC3
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Product OPENEYE NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(cyclohexylmethyl)acetamide
CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-(cyclohexylmethyl)acetamide
IUPAC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(cyclohexylmethyl)acetamide
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(cyclohexylmethyl)ethanamide
MOLECULAR FORMULA: C19H29ClN3O3S+
MOLECULAR WEIGHT: 414.96986
SMILES: C1CCC(CC1)CNC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(cyclohexylmethyl)acetamide
CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-N-(cyclohexylmethyl)acetamide
IUPAC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(cyclohexylmethyl)acetamide
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(cyclohexylmethyl)ethanamide
MOLECULAR FORMULA: C19H28ClN3O3S
MOLECULAR WEIGHT: 413.96192
SMILES: C1CCC(CC1)CNC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: [(1R)-2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-methyl-2-oxo-ethyl] 2-(2-chlorophenoxy)acetate
CAS Name: 2-(2-chlorophenoxy)acetic acid [(2R)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxopropan-2-yl] 2-(2-chlorophenoxy)acetate
SYSTEMATIC NAME: [(2R)-1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxidanylidene-propan-2-yl] 2-(2-chloranylphenoxy)ethanoate
MOLECULAR FORMULA: C19H20ClNO5
MOLECULAR WEIGHT: 377.8188
SMILES: CC1=C(NC(=C1C(=O)C)C)C(=O)[C@@H](C)OC(=O)COC2=CC=CC=C2Cl
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Product OPENEYE NAME: 2-[[(3,5-dimethoxybenzoyl)amino]carbamothioylamino]ethyl-dimethyl-ammonium
CAS Name: 2-[[[[(3,5-dimethoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]amino]ethyl-dimethylammonium
IUPAC NAME: 2-[[(3,5-dimethoxybenzoyl)amino]carbamothioylamino]ethyl-dimethylazanium
SYSTEMATIC NAME: 2-[[(3,5-dimethoxyphenyl)carbonylamino]carbamothioylamino]ethyl-dimethyl-azanium
MOLECULAR FORMULA: C14H23N4O3S+
MOLECULAR WEIGHT: 327.42242
SMILES: C[NH+](C)CCNC(=S)NNC(=O)C1=CC(=CC(=C1)OC)OC
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Product OPENEYE NAME: 1-[(3,5-dimethoxybenzoyl)amino]-3-[2-(dimethylamino)ethyl]thiourea
CAS Name: 1-[[(3,5-dimethoxyphenyl)-oxomethyl]amino]-3-[2-(dimethylamino)ethyl]thiourea
IUPAC NAME: 1-[(3,5-dimethoxybenzoyl)amino]-3-[2-(dimethylamino)ethyl]thiourea
SYSTEMATIC NAME: 1-[(3,5-dimethoxyphenyl)carbonylamino]-3-[2-(dimethylamino)ethyl]thiourea
MOLECULAR FORMULA: C14H22N4O3S
MOLECULAR WEIGHT: 326.41448
SMILES: CN(C)CCNC(=S)NNC(=O)C1=CC(=CC(=C1)OC)OC
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Product OPENEYE NAME: [(1R)-2-(1,3-benzodioxol-5-ylamino)-1-methyl-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [(2R)-1-(1,3-benzodioxol-5-ylamino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(1,3-benzodioxol-5-ylamino)-1-oxopropan-2-yl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [(2R)-1-(1,3-benzodioxol-5-ylamino)-1-oxidanylidene-propan-2-yl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C20H17NO6
MOLECULAR WEIGHT: 367.35208
SMILES: C[C@H](C(=O)NC1=CC2=C(C=C1)OCO2)OC(=O)C3=CC4=CC=CC=C4OC3
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Product OPENEYE NAME: N-(3,4-dimethylphenyl)-6-oxo-1H-pyridine-3-carboxamide
CAS Name: N-(3,4-dimethylphenyl)-6-oxo-1H-pyridine-3-carboxamide
IUPAC NAME: N-(3,4-dimethylphenyl)-6-oxo-1H-pyridine-3-carboxamide
SYSTEMATIC NAME: N-(3,4-dimethylphenyl)-6-oxidanylidene-1H-pyridine-3-carboxamide
MOLECULAR FORMULA: C14H14N2O2
MOLECULAR WEIGHT: 242.27316
SMILES: CC1=C(C=C(C=C1)NC(=O)C2=CNC(=O)C=C2)C
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Product OPENEYE NAME: (5S,7R)-3-bromo-N-(3,4-dimethylphenyl)adamantane-1-carboxamide
CAS Name: (5S,7R)-3-bromo-N-(3,4-dimethylphenyl)-1-adamantanecarboxamide
IUPAC NAME: (5S,7R)-3-bromo-N-(3,4-dimethylphenyl)adamantane-1-carboxamide
SYSTEMATIC NAME: (5S,7R)-3-bromanyl-N-(3,4-dimethylphenyl)adamantane-1-carboxamide
MOLECULAR FORMULA: C19H24BrNO
MOLECULAR WEIGHT: 362.30396
SMILES: CC1=C(C=C(C=C1)NC(=O)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)Br)C
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Product OPENEYE NAME: 1-[(3,5-dimethoxybenzoyl)amino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea
CAS Name: 1-[[(3,5-dimethoxyphenyl)-oxomethyl]amino]-3-[3-(4-morpholin-4-iumyl)propyl]thiourea
IUPAC NAME: 1-[(3,5-dimethoxybenzoyl)amino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea
SYSTEMATIC NAME: 1-[(3,5-dimethoxyphenyl)carbonylamino]-3-(3-morpholin-4-ium-4-ylpropyl)thiourea
MOLECULAR FORMULA: C17H27N4O4S+
MOLECULAR WEIGHT: 383.48568
SMILES: COC1=CC(=CC(=C1)C(=O)NNC(=S)NCCC[NH+]2CCOCC2)OC
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Product OPENEYE NAME: 1-[(3,5-dimethoxybenzoyl)amino]-3-(3-morpholinopropyl)thiourea
CAS Name: 1-[[(3,5-dimethoxyphenyl)-oxomethyl]amino]-3-[3-(4-morpholinyl)propyl]thiourea
IUPAC NAME: 1-[(3,5-dimethoxybenzoyl)amino]-3-(3-morpholin-4-ylpropyl)thiourea
SYSTEMATIC NAME: 1-[(3,5-dimethoxyphenyl)carbonylamino]-3-(3-morpholin-4-ylpropyl)thiourea
MOLECULAR FORMULA: C17H26N4O4S
MOLECULAR WEIGHT: 382.47774
SMILES: COC1=CC(=CC(=C1)C(=O)NNC(=S)NCCCN2CCOCC2)OC
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Product OPENEYE NAME: [(1S)-2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-methyl-2-oxo-ethyl] 2-(2-chlorophenoxy)acetate
CAS Name: 2-(2-chlorophenoxy)acetic acid [(2S)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxopropan-2-yl] 2-(2-chlorophenoxy)acetate
SYSTEMATIC NAME: [(2S)-1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxidanylidene-propan-2-yl] 2-(2-chloranylphenoxy)ethanoate
MOLECULAR FORMULA: C19H20ClNO5
MOLECULAR WEIGHT: 377.8188
SMILES: CC1=C(NC(=C1C(=O)C)C)C(=O)[C@H](C)OC(=O)COC2=CC=CC=C2Cl
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Product OPENEYE NAME: [(1S)-2-(3-cyanoanilino)-1-methyl-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [(2S)-1-(3-cyanoanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(3-cyanoanilino)-1-oxopropan-2-yl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [(2S)-1-[(3-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C20H16N2O4
MOLECULAR WEIGHT: 348.35204
SMILES: C[C@@H](C(=O)NC1=CC=CC(=C1)C#N)OC(=O)C2=CC3=CC=CC=C3OC2
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Product OPENEYE NAME: 3-cyano-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]benzamide
CAS Name: 3-cyano-N-[2-[(2-fluorophenyl)methylthio]ethyl]benzamide
IUPAC NAME: 3-cyano-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]benzamide
SYSTEMATIC NAME: 3-cyano-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]benzamide
MOLECULAR FORMULA: C17H15FN2OS
MOLECULAR WEIGHT: 314.377203
SMILES: C1=CC=C(C(=C1)CSCCNC(=O)C2=CC=CC(=C2)C#N)F
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Product OPENEYE NAME: 1-[(3,5-dimethoxybenzoyl)amino]-3-(3-methylsulfanylpropyl)thiourea
CAS Name: 1-[[(3,5-dimethoxyphenyl)-oxomethyl]amino]-3-[3-(methylthio)propyl]thiourea
IUPAC NAME: 1-[(3,5-dimethoxybenzoyl)amino]-3-(3-methylsulfanylpropyl)thiourea
SYSTEMATIC NAME: 1-[(3,5-dimethoxyphenyl)carbonylamino]-3-(3-methylsulfanylpropyl)thiourea
MOLECULAR FORMULA: C14H21N3O3S2
MOLECULAR WEIGHT: 343.46484
SMILES: COC1=CC(=CC(=C1)C(=O)NNC(=S)NCCCSC)OC
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Product OPENEYE NAME: [(1R)-2-(3-cyanoanilino)-1-methyl-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [(2R)-1-(3-cyanoanilino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(3-cyanoanilino)-1-oxopropan-2-yl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [(2R)-1-[(3-cyanophenyl)amino]-1-oxidanylidene-propan-2-yl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C20H16N2O4
MOLECULAR WEIGHT: 348.35204
SMILES: C[C@H](C(=O)NC1=CC=CC(=C1)C#N)OC(=O)C2=CC3=CC=CC=C3OC2
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Product OPENEYE NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(4-ethylphenyl)acetamide
CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-(4-ethylphenyl)acetamide
IUPAC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(4-ethylphenyl)acetamide
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(4-ethylphenyl)ethanamide
MOLECULAR FORMULA: C20H25ClN3O3S+
MOLECULAR WEIGHT: 422.9488
SMILES: CCC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(4-ethylphenyl)acetamide
CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-N-(4-ethylphenyl)acetamide
IUPAC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(4-ethylphenyl)acetamide
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(4-ethylphenyl)ethanamide
MOLECULAR FORMULA: C20H24ClN3O3S
MOLECULAR WEIGHT: 421.94086
SMILES: CCC1=CC=C(C=C1)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 1-(2-chloro-5-nitro-phenyl)-3-[(3,5-dimethoxybenzoyl)amino]thiourea
CAS Name: 1-(2-chloro-5-nitrophenyl)-3-[[(3,5-dimethoxyphenyl)-oxomethyl]amino]thiourea
IUPAC NAME: 1-(2-chloro-5-nitrophenyl)-3-[(3,5-dimethoxybenzoyl)amino]thiourea
SYSTEMATIC NAME: 1-(2-chloranyl-5-nitro-phenyl)-3-[(3,5-dimethoxyphenyl)carbonylamino]thiourea
MOLECULAR FORMULA: C16H15ClN4O5S
MOLECULAR WEIGHT: 410.8321
SMILES: COC1=CC(=CC(=C1)C(=O)NNC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl)OC
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Product OPENEYE NAME: [2-(3-thienyl)thiazol-4-yl]methyl 2-(2-chlorophenoxy)acetate
CAS Name: 2-(2-chlorophenoxy)acetic acid [2-(3-thiophenyl)-4-thiazolyl]methyl ester
IUPAC NAME: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 2-(2-chlorophenoxy)acetate
SYSTEMATIC NAME: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 2-(2-chloranylphenoxy)ethanoate
MOLECULAR FORMULA: C16H12ClNO3S2
MOLECULAR WEIGHT: 365.85438
SMILES: C1=CC=C(C(=C1)OCC(=O)OCC2=CSC(=N2)C3=CSC=C3)Cl
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Product OPENEYE NAME: N-(3,4-dimethylphenyl)-3-[4-(1-piperidylsulfonyl)phenyl]propanamide
CAS Name: N-(3,4-dimethylphenyl)-3-[4-(1-piperidinylsulfonyl)phenyl]propanamide
IUPAC NAME: N-(3,4-dimethylphenyl)-3-(4-piperidin-1-ylsulfonylphenyl)propanamide
SYSTEMATIC NAME: N-(3,4-dimethylphenyl)-3-(4-piperidin-1-ylsulfonylphenyl)propanamide
MOLECULAR FORMULA: C22H28N2O3S
MOLECULAR WEIGHT: 400.53432
SMILES: CC1=C(C=C(C=C1)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)C
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Product OPENEYE NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-phenylethyl)acetamide
CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-(2-phenylethyl)acetamide
IUPAC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-phenylethyl)acetamide
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-phenylethyl)ethanamide
MOLECULAR FORMULA: C20H25ClN3O3S+
MOLECULAR WEIGHT: 422.9488
SMILES: C1CN(CC[NH+]1CC(=O)NCCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Cl
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All Chemical Compounds Information

Product OPENEYE NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(2-cyanophenyl)acetamide
CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-N-(2-cyanophenyl)acetamide
IUPAC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(2-cyanophenyl)acetamide
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(2-cyanophenyl)ethanamide
MOLECULAR FORMULA: C19H19ClN4O3S
MOLECULAR WEIGHT: 418.89716
SMILES: C1CN(CCN1CC(=O)NC2=CC=CC=C2C#N)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 1-[2-[(5Z)-5-[[4-(difluoromethoxy)phenyl]methylene]-2,4-dioxo-thiazolidin-3-yl]ethyl]-3-propyl-thiourea
CAS Name: 1-[2-[(5Z)-5-[[4-(difluoromethoxy)phenyl]methylidene]-2,4-dioxo-3-thiazolidinyl]ethyl]-3-propylthiourea
IUPAC NAME: 1-[2-[(5Z)-5-[[4-(difluoromethoxy)phenyl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-3-propylthiourea
SYSTEMATIC NAME: 1-[2-[(5Z)-5-[[4-[bis(fluoranyl)methoxy]phenyl]methylidene]-2,4-bis(oxidanylidene)-1,3-thiazolidin-3-yl]ethyl]-3-propyl-thiourea
MOLECULAR FORMULA: C17H19F2N3O3S2
MOLECULAR WEIGHT: 415.477866
SMILES: CCCNC(=S)NCCN1C(=O)/C(=C/C2=CC=C(C=C2)OC(F)F)/SC1=O
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Product OPENEYE NAME: 2-(4-ethoxyphenoxy)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]acetamide
CAS Name: 2-(4-ethoxyphenoxy)-N-[2-[(2-fluorophenyl)methylthio]ethyl]acetamide
IUPAC NAME: 2-(4-ethoxyphenoxy)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]acetamide
SYSTEMATIC NAME: 2-(4-ethoxyphenoxy)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]ethanamide
MOLECULAR FORMULA: C19H22FNO3S
MOLECULAR WEIGHT: 363.446283
SMILES: CCOC1=CC=C(C=C1)OCC(=O)NCCSCC2=CC=CC=C2F
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Product OPENEYE NAME: [(1R)-1-methyl-2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] 2-(2-chlorophenoxy)acetate
CAS Name: 2-(2-chlorophenoxy)acetic acid [(2R)-1-oxo-1-[(1,3,5-trimethyl-4-pyrazolyl)amino]propan-2-yl] ester
IUPAC NAME: [(2R)-1-oxo-1-[(1,3,5-trimethylpyrazol-4-yl)amino]propan-2-yl] 2-(2-chlorophenoxy)acetate
SYSTEMATIC NAME: [(2R)-1-oxidanylidene-1-[(1,3,5-trimethylpyrazol-4-yl)amino]propan-2-yl] 2-(2-chloranylphenoxy)ethanoate
MOLECULAR FORMULA: C17H20ClN3O4
MOLECULAR WEIGHT: 365.8114
SMILES: CC1=C(C(=NN1C)C)NC(=O)[C@@H](C)OC(=O)COC2=CC=CC=C2Cl
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Product OPENEYE NAME: [(1S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-methyl-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [(2S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [(2S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxidanylidene-propan-2-yl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C21H19NO6
MOLECULAR WEIGHT: 381.37866
SMILES: C[C@@H](C(=O)NC1=CC2=C(C=C1)OCCO2)OC(=O)C3=CC4=CC=CC=C4OC3
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Product OPENEYE NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(o-tolyl)acetamide
CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-(2-methylphenyl)acetamide
IUPAC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-methylphenyl)acetamide
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-methylphenyl)ethanamide
MOLECULAR FORMULA: C19H23ClN3O3S+
MOLECULAR WEIGHT: 408.92222
SMILES: CC1=CC=CC=C1NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(o-tolyl)acetamide
CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-N-(2-methylphenyl)acetamide
IUPAC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(2-methylphenyl)acetamide
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(2-methylphenyl)ethanamide
MOLECULAR FORMULA: C19H22ClN3O3S
MOLECULAR WEIGHT: 407.91428
SMILES: CC1=CC=CC=C1NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 1-cyclopropyl-3-[2-[(5Z)-5-[[4-(difluoromethoxy)phenyl]methylene]-2,4-dioxo-thiazolidin-3-yl]ethyl]thiourea
CAS Name: 1-cyclopropyl-3-[2-[(5Z)-5-[[4-(difluoromethoxy)phenyl]methylidene]-2,4-dioxo-3-thiazolidinyl]ethyl]thiourea
IUPAC NAME: 1-cyclopropyl-3-[2-[(5Z)-5-[[4-(difluoromethoxy)phenyl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]thiourea
SYSTEMATIC NAME: 1-[2-[(5Z)-5-[[4-[bis(fluoranyl)methoxy]phenyl]methylidene]-2,4-bis(oxidanylidene)-1,3-thiazolidin-3-yl]ethyl]-3-cyclopropyl-thiourea
MOLECULAR FORMULA: C17H17F2N3O3S2
MOLECULAR WEIGHT: 413.461986
SMILES: C1CC1NC(=S)NCCN2C(=O)/C(=C/C3=CC=C(C=C3)OC(F)F)/SC2=O
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Product OPENEYE NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(3-cyanophenyl)acetamide
CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-(3-cyanophenyl)acetamide
IUPAC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(3-cyanophenyl)acetamide
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(3-cyanophenyl)ethanamide
MOLECULAR FORMULA: C19H20ClN4O3S+
MOLECULAR WEIGHT: 419.9051
SMILES: C1CN(CC[NH+]1CC(=O)NC2=CC=CC(=C2)C#N)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(3-cyanophenyl)acetamide
CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-N-(3-cyanophenyl)acetamide
IUPAC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(3-cyanophenyl)acetamide
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(3-cyanophenyl)ethanamide
MOLECULAR FORMULA: C19H19ClN4O3S
MOLECULAR WEIGHT: 418.89716
SMILES: C1CN(CCN1CC(=O)NC2=CC=CC(=C2)C#N)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2-[(2R)-3-oxo-4H-1,4-benzothiazin-2-yl]acetamide
CAS Name: N-[2-[(2-fluorophenyl)methylthio]ethyl]-2-[(2R)-3-oxo-4H-1,4-benzothiazin-2-yl]acetamide
IUPAC NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2-[(2R)-3-oxo-4H-1,4-benzothiazin-2-yl]acetamide
SYSTEMATIC NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2-[(2R)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]ethanamide
MOLECULAR FORMULA: C19H19FN2O2S2
MOLECULAR WEIGHT: 390.494763
SMILES: C1=CC=C(C(=C1)CSCCNC(=O)C[C@@H]2C(=O)NC3=CC=CC=C3S2)F
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Product OPENEYE NAME: [(1R)-2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-methyl-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [(2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxopropan-2-yl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [(2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-oxidanylidene-propan-2-yl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C21H19NO6
MOLECULAR WEIGHT: 381.37866
SMILES: C[C@H](C(=O)NC1=CC2=C(C=C1)OCCO2)OC(=O)C3=CC4=CC=CC=C4OC3
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Product OPENEYE NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-indolin-1-yl-ethanone
CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]-1-(2,3-dihydroindol-1-yl)ethanone
IUPAC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-(2,3-dihydroindol-1-yl)ethanone
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-1-(2,3-dihydroindol-1-yl)ethanone
MOLECULAR FORMULA: C20H23ClN3O3S+
MOLECULAR WEIGHT: 420.93292
SMILES: C1CN(C2=CC=CC=C21)C(=O)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Cl
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Product OPENEYE NAME: 1-[(3,5-dimethoxybenzoyl)amino]-3-(2-methylallyl)thiourea
CAS Name: 1-[[(3,5-dimethoxyphenyl)-oxomethyl]amino]-3-(2-methylprop-2-enyl)thiourea
IUPAC NAME: 1-[(3,5-dimethoxybenzoyl)amino]-3-(2-methylprop-2-enyl)thiourea
SYSTEMATIC NAME: 1-[(3,5-dimethoxyphenyl)carbonylamino]-3-(2-methylprop-2-enyl)thiourea
MOLECULAR FORMULA: C14H19N3O3S
MOLECULAR WEIGHT: 309.38396
SMILES: CC(=C)CNC(=S)NNC(=O)C1=CC(=CC(=C1)OC)OC
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Product OPENEYE NAME: 1-(3-chloro-4-methyl-phenyl)-3-[(3,5-dimethoxybenzoyl)amino]thiourea
CAS Name: 1-(3-chloro-4-methylphenyl)-3-[[(3,5-dimethoxyphenyl)-oxomethyl]amino]thiourea
IUPAC NAME: 1-(3-chloro-4-methylphenyl)-3-[(3,5-dimethoxybenzoyl)amino]thiourea
SYSTEMATIC NAME: 1-(3-chloranyl-4-methyl-phenyl)-3-[(3,5-dimethoxyphenyl)carbonylamino]thiourea
MOLECULAR FORMULA: C17H18ClN3O3S
MOLECULAR WEIGHT: 379.86112
SMILES: CC1=C(C=C(C=C1)NC(=S)NNC(=O)C2=CC(=CC(=C2)OC)OC)Cl
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Product OPENEYE NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-phenyl-acetamide
CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-phenylacetamide
IUPAC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-phenylacetamide
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-phenyl-ethanamide
MOLECULAR FORMULA: C18H21ClN3O3S+
MOLECULAR WEIGHT: 394.89564
SMILES: C1CN(CC[NH+]1CC(=O)NC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-phenyl-acetamide
CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-N-phenylacetamide
IUPAC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-phenylacetamide
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-phenyl-ethanamide
MOLECULAR FORMULA: C18H20ClN3O3S
MOLECULAR WEIGHT: 393.8877
SMILES: C1CN(CCN1CC(=O)NC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: [(1S)-1-methyl-2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] 2-(2-chlorophenoxy)acetate
CAS Name: 2-(2-chlorophenoxy)acetic acid [(2S)-1-oxo-1-[(1,3,5-trimethyl-4-pyrazolyl)amino]propan-2-yl] ester
IUPAC NAME: [(2S)-1-oxo-1-[(1,3,5-trimethylpyrazol-4-yl)amino]propan-2-yl] 2-(2-chlorophenoxy)acetate
SYSTEMATIC NAME: [(2S)-1-oxidanylidene-1-[(1,3,5-trimethylpyrazol-4-yl)amino]propan-2-yl] 2-(2-chloranylphenoxy)ethanoate
MOLECULAR FORMULA: C17H20ClN3O4
MOLECULAR WEIGHT: 365.8114
SMILES: CC1=C(C(=NN1C)C)NC(=O)[C@H](C)OC(=O)COC2=CC=CC=C2Cl
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Product OPENEYE NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2-[(2S)-3-oxo-4H-1,4-benzothiazin-2-yl]acetamide
CAS Name: N-[2-[(2-fluorophenyl)methylthio]ethyl]-2-[(2S)-3-oxo-4H-1,4-benzothiazin-2-yl]acetamide
IUPAC NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2-[(2S)-3-oxo-4H-1,4-benzothiazin-2-yl]acetamide
SYSTEMATIC NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2-[(2S)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]ethanamide
MOLECULAR FORMULA: C19H19FN2O2S2
MOLECULAR WEIGHT: 390.494763
SMILES: C1=CC=C(C(=C1)CSCCNC(=O)C[C@H]2C(=O)NC3=CC=CC=C3S2)F
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All Chemical Compounds Information

Product OPENEYE NAME: 3-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]propanenitrile
CAS Name: 3-[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]propanenitrile
IUPAC NAME: 3-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]propanenitrile
SYSTEMATIC NAME: 3-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]propanenitrile
MOLECULAR FORMULA: C13H17ClN3O2S+
MOLECULAR WEIGHT: 314.81098
SMILES: C1CN(CC[NH+]1CCC#N)S(=O)(=O)C2=CC=C(C=C2)Cl
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Product OPENEYE NAME: 3-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]propanenitrile
CAS Name: 3-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]propanenitrile
IUPAC NAME: 3-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]propanenitrile
SYSTEMATIC NAME: 3-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]propanenitrile
MOLECULAR FORMULA: C13H16ClN3O2S
MOLECULAR WEIGHT: 313.80304
SMILES: C1CN(CCN1CCC#N)S(=O)(=O)C2=CC=C(C=C2)Cl
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Product OPENEYE NAME: (1S,2R)-N-(3,4-dimethylphenyl)-2-methyl-cyclopropanecarboxamide
CAS Name: (1S,2R)-N-(3,4-dimethylphenyl)-2-methyl-1-cyclopropanecarboxamide
IUPAC NAME: (1S,2R)-N-(3,4-dimethylphenyl)-2-methylcyclopropane-1-carboxamide
SYSTEMATIC NAME: (1S,2R)-N-(3,4-dimethylphenyl)-2-methyl-cyclopropane-1-carboxamide
MOLECULAR FORMULA: C13H17NO
MOLECULAR WEIGHT: 203.28018
SMILES: C[C@@H]1C[C@@H]1C(=O)NC2=CC(=C(C=C2)C)C
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Product OPENEYE NAME: 1-allyl-3-[2-[(5Z)-5-[[4-(difluoromethoxy)phenyl]methylene]-2,4-dioxo-thiazolidin-3-yl]ethyl]thiourea
CAS Name: 1-[2-[(5Z)-5-[[4-(difluoromethoxy)phenyl]methylidene]-2,4-dioxo-3-thiazolidinyl]ethyl]-3-prop-2-enylthiourea
IUPAC NAME: 1-[2-[(5Z)-5-[[4-(difluoromethoxy)phenyl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-3-prop-2-enylthiourea
SYSTEMATIC NAME: 1-[2-[(5Z)-5-[[4-[bis(fluoranyl)methoxy]phenyl]methylidene]-2,4-bis(oxidanylidene)-1,3-thiazolidin-3-yl]ethyl]-3-prop-2-enyl-thiourea
MOLECULAR FORMULA: C17H17F2N3O3S2
MOLECULAR WEIGHT: 413.461986
SMILES: C=CCNC(=S)NCCN1C(=O)/C(=C/C2=CC=C(C=C2)OC(F)F)/SC1=O
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Product OPENEYE NAME: [2-oxo-2-(2-oxooxazolidin-3-yl)ethyl] 1-phenyl-3-(p-tolyl)pyrazole-4-carboxylate
CAS Name: 3-(4-methylphenyl)-1-phenyl-4-pyrazolecarboxylic acid [2-oxo-2-(2-oxo-3-oxazolidinyl)ethyl] ester
IUPAC NAME: [2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl] 3-(4-methylphenyl)-1-phenylpyrazole-4-carboxylate
SYSTEMATIC NAME: [2-oxidanylidene-2-(2-oxidanylidene-1,3-oxazolidin-3-yl)ethyl] 3-(4-methylphenyl)-1-phenyl-pyrazole-4-carboxylate
MOLECULAR FORMULA: C22H19N3O5
MOLECULAR WEIGHT: 405.40336
SMILES: CC1=CC=C(C=C1)C2=NN(C=C2C(=O)OCC(=O)N3CCOC3=O)C4=CC=CC=C4
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Product OPENEYE NAME: [(1R)-2-[2-(cyclohexen-1-yl)ethylamino]-1-methyl-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [(2R)-1-[2-(1-cyclohexenyl)ethylamino]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-[2-(cyclohexen-1-yl)ethylamino]-1-oxopropan-2-yl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [(2R)-1-[2-(cyclohexen-1-yl)ethylamino]-1-oxidanylidene-propan-2-yl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C21H25NO4
MOLECULAR WEIGHT: 355.4275
SMILES: C[C@H](C(=O)NCCC1=CCCCC1)OC(=O)C2=CC3=CC=CC=C3OC2
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Product OPENEYE NAME: 1-[2-[(5Z)-5-[[4-(difluoromethoxy)phenyl]methylene]-2,4-dioxo-thiazolidin-3-yl]ethyl]-3-methyl-thiourea
CAS Name: 1-[2-[(5Z)-5-[[4-(difluoromethoxy)phenyl]methylidene]-2,4-dioxo-3-thiazolidinyl]ethyl]-3-methylthiourea
IUPAC NAME: 1-[2-[(5Z)-5-[[4-(difluoromethoxy)phenyl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-3-methylthiourea
SYSTEMATIC NAME: 1-[2-[(5Z)-5-[[4-[bis(fluoranyl)methoxy]phenyl]methylidene]-2,4-bis(oxidanylidene)-1,3-thiazolidin-3-yl]ethyl]-3-methyl-thiourea
MOLECULAR FORMULA: C15H15F2N3O3S2
MOLECULAR WEIGHT: 387.424706
SMILES: CNC(=S)NCCN1C(=O)/C(=C/C2=CC=C(C=C2)OC(F)F)/SC1=O
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Product OPENEYE NAME: (1R,2S)-N-(3,4-dimethylphenyl)-2-methyl-cyclopropanecarboxamide
CAS Name: (1R,2S)-N-(3,4-dimethylphenyl)-2-methyl-1-cyclopropanecarboxamide
IUPAC NAME: (1R,2S)-N-(3,4-dimethylphenyl)-2-methylcyclopropane-1-carboxamide
SYSTEMATIC NAME: (1R,2S)-N-(3,4-dimethylphenyl)-2-methyl-cyclopropane-1-carboxamide
MOLECULAR FORMULA: C13H17NO
MOLECULAR WEIGHT: 203.28018
SMILES: C[C@H]1C[C@H]1C(=O)NC2=CC(=C(C=C2)C)C
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Product OPENEYE NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-furylmethyl)acetamide
CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-(2-furanylmethyl)acetamide
IUPAC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(furan-2-ylmethyl)acetamide
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(furan-2-ylmethyl)ethanamide
MOLECULAR FORMULA: C17H21ClN3O4S+
MOLECULAR WEIGHT: 398.88434
SMILES: C1CN(CC[NH+]1CC(=O)NCC2=CC=CO2)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(2-furylmethyl)acetamide
CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-N-(2-furanylmethyl)acetamide
IUPAC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(furan-2-ylmethyl)acetamide
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(furan-2-ylmethyl)ethanamide
MOLECULAR FORMULA: C17H20ClN3O4S
MOLECULAR WEIGHT: 397.8764
SMILES: C1CN(CCN1CC(=O)NCC2=CC=CO2)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: [5-(2-thienyl)isoxazol-3-yl]methyl 2-(2-chlorophenoxy)acetate
CAS Name: 2-(2-chlorophenoxy)acetic acid (5-thiophen-2-yl-3-isoxazolyl)methyl ester
IUPAC NAME: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 2-(2-chlorophenoxy)acetate
SYSTEMATIC NAME: (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 2-(2-chloranylphenoxy)ethanoate
MOLECULAR FORMULA: C16H12ClNO4S
MOLECULAR WEIGHT: 349.78878
SMILES: C1=CC=C(C(=C1)OCC(=O)OCC2=NOC(=C2)C3=CC=CS3)Cl
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Product OPENEYE NAME: (1S,2S)-N-(3,4-dimethylphenyl)-2-methyl-cyclopropanecarboxamide
CAS Name: (1S,2S)-N-(3,4-dimethylphenyl)-2-methyl-1-cyclopropanecarboxamide
IUPAC NAME: (1S,2S)-N-(3,4-dimethylphenyl)-2-methylcyclopropane-1-carboxamide
SYSTEMATIC NAME: (1S,2S)-N-(3,4-dimethylphenyl)-2-methyl-cyclopropane-1-carboxamide
MOLECULAR FORMULA: C13H17NO
MOLECULAR WEIGHT: 203.28018
SMILES: C[C@H]1C[C@@H]1C(=O)NC2=CC(=C(C=C2)C)C
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Product OPENEYE NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2-indan-5-yloxy-acetamide
CAS Name: 2-(2,3-dihydro-1H-inden-5-yloxy)-N-[2-[(2-fluorophenyl)methylthio]ethyl]acetamide
IUPAC NAME: 2-(2,3-dihydro-1H-inden-5-yloxy)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]acetamide
SYSTEMATIC NAME: 2-(2,3-dihydro-1H-inden-5-yloxy)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]ethanamide
MOLECULAR FORMULA: C20H22FNO2S
MOLECULAR WEIGHT: 359.457583
SMILES: C1CC2=C(C1)C=C(C=C2)OCC(=O)NCCSCC3=CC=CC=C3F
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Product OPENEYE NAME: 1-[2-[(5Z)-5-[[4-(difluoromethoxy)phenyl]methylene]-2,4-dioxo-thiazolidin-3-yl]ethyl]-3-ethyl-thiourea
CAS Name: 1-[2-[(5Z)-5-[[4-(difluoromethoxy)phenyl]methylidene]-2,4-dioxo-3-thiazolidinyl]ethyl]-3-ethylthiourea
IUPAC NAME: 1-[2-[(5Z)-5-[[4-(difluoromethoxy)phenyl]methylidene]-2,4-dioxo-1,3-thiazolidin-3-yl]ethyl]-3-ethylthiourea
SYSTEMATIC NAME: 1-[2-[(5Z)-5-[[4-[bis(fluoranyl)methoxy]phenyl]methylidene]-2,4-bis(oxidanylidene)-1,3-thiazolidin-3-yl]ethyl]-3-ethyl-thiourea
MOLECULAR FORMULA: C16H17F2N3O3S2
MOLECULAR WEIGHT: 401.451286
SMILES: CCNC(=S)NCCN1C(=O)/C(=C/C2=CC=C(C=C2)OC(F)F)/SC1=O
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Product OPENEYE NAME: [2-oxo-2-[4-(2-oxopyrrolidin-1-yl)phenyl]ethyl] 2-(2-chlorophenoxy)acetate
CAS Name: 2-(2-chlorophenoxy)acetic acid [2-oxo-2-[4-(2-oxo-1-pyrrolidinyl)phenyl]ethyl] ester
IUPAC NAME: [2-oxo-2-[4-(2-oxopyrrolidin-1-yl)phenyl]ethyl] 2-(2-chlorophenoxy)acetate
SYSTEMATIC NAME: [2-oxidanylidene-2-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]ethyl] 2-(2-chloranylphenoxy)ethanoate
MOLECULAR FORMULA: C20H18ClNO5
MOLECULAR WEIGHT: 387.81362
SMILES: C1CC(=O)N(C1)C2=CC=C(C=C2)C(=O)COC(=O)COC3=CC=CC=C3Cl
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Product OPENEYE NAME: [2-(ethoxycarbonylamino)-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-(ethoxycarbonylamino)-2-oxoethyl] ester
IUPAC NAME: [2-(ethoxycarbonylamino)-2-oxoethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [2-(ethoxycarbonylamino)-2-oxidanylidene-ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C15H15NO6
MOLECULAR WEIGHT: 305.2827
SMILES: CCOC(=O)NC(=O)COC(=O)C1=CC2=CC=CC=C2OC1
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Product OPENEYE NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-cyanophenyl)acetamide
CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-(2-cyanophenyl)acetamide
IUPAC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-cyanophenyl)acetamide
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(2-cyanophenyl)ethanamide
MOLECULAR FORMULA: C19H20ClN4O3S+
MOLECULAR WEIGHT: 419.9051
SMILES: C1CN(CC[NH+]1CC(=O)NC2=CC=CC=C2C#N)S(=O)(=O)C3=CC=C(C=C3)Cl
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All Chemical Compounds Information

Product OPENEYE NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]benzofuran-2-carboxamide
CAS Name: N-[2-[(2-fluorophenyl)methylthio]ethyl]-2-benzofurancarboxamide
IUPAC NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-1-benzofuran-2-carboxamide
SYSTEMATIC NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-1-benzofuran-2-carboxamide
MOLECULAR FORMULA: C18H16FNO2S
MOLECULAR WEIGHT: 329.388543
SMILES: C1=CC=C2C(=C1)C=C(O2)C(=O)NCCSCC3=CC=CC=C3F
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Product OPENEYE NAME: 1-(azepan-1-yl)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]ethanone
CAS Name: 1-(1-azepanyl)-2-[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]ethanone
IUPAC NAME: 1-(azepan-1-yl)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]ethanone
SYSTEMATIC NAME: 1-(azepan-1-yl)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]ethanone
MOLECULAR FORMULA: C18H27ClN3O3S+
MOLECULAR WEIGHT: 400.94328
SMILES: C1CCCN(CC1)C(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 1-(azepan-1-yl)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]ethanone
CAS Name: 1-(1-azepanyl)-2-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]ethanone
IUPAC NAME: 1-(azepan-1-yl)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]ethanone
SYSTEMATIC NAME: 1-(azepan-1-yl)-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]ethanone
MOLECULAR FORMULA: C18H26ClN3O3S
MOLECULAR WEIGHT: 399.93534
SMILES: C1CCCN(CC1)C(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 1-(3-methylsulfanylpropyl)-3-[(E)-(2-oxo-1-propyl-indolin-3-ylidene)amino]thiourea
CAS Name: 1-[3-(methylthio)propyl]-3-[(E)-(2-oxo-1-propyl-3-indolylidene)amino]thiourea
IUPAC NAME: 1-(3-methylsulfanylpropyl)-3-[(E)-(2-oxo-1-propylindol-3-ylidene)amino]thiourea
SYSTEMATIC NAME: 1-(3-methylsulfanylpropyl)-3-[(E)-(2-oxidanylidene-1-propyl-indol-3-ylidene)amino]thiourea
MOLECULAR FORMULA: C16H22N4OS2
MOLECULAR WEIGHT: 350.50208
SMILES: CCCN1C2=CC=CC=C2/C(=N\NC(=S)NCCCSC)/C1=O
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Product OPENEYE NAME: N-(3,4-dimethylphenyl)-2-[3-(trifluoromethyl)phenyl]acetamide
CAS Name: N-(3,4-dimethylphenyl)-2-[3-(trifluoromethyl)phenyl]acetamide
IUPAC NAME: N-(3,4-dimethylphenyl)-2-[3-(trifluoromethyl)phenyl]acetamide
SYSTEMATIC NAME: N-(3,4-dimethylphenyl)-2-[3-(trifluoromethyl)phenyl]ethanamide
MOLECULAR FORMULA: C17H16F3NO
MOLECULAR WEIGHT: 307.31025
SMILES: CC1=C(C=C(C=C1)NC(=O)CC2=CC(=CC=C2)C(F)(F)F)C
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Product OPENEYE NAME: N-benzyl-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-methyl-acetamide
CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-methyl-N-(phenylmethyl)acetamide
IUPAC NAME: N-benzyl-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-methylacetamide
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-methyl-N-(phenylmethyl)ethanamide
MOLECULAR FORMULA: C20H25ClN3O3S+
MOLECULAR WEIGHT: 422.9488
SMILES: CN(CC1=CC=CC=C1)C(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: N-benzyl-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-methyl-acetamide
CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-N-methyl-N-(phenylmethyl)acetamide
IUPAC NAME: N-benzyl-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-methylacetamide
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-methyl-N-(phenylmethyl)ethanamide
MOLECULAR FORMULA: C20H24ClN3O3S
MOLECULAR WEIGHT: 421.94086
SMILES: CN(CC1=CC=CC=C1)C(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: (1R,2R)-N-(3,4-dimethylphenyl)-2-methyl-cyclopropanecarboxamide
CAS Name: (1R,2R)-N-(3,4-dimethylphenyl)-2-methyl-1-cyclopropanecarboxamide
IUPAC NAME: (1R,2R)-N-(3,4-dimethylphenyl)-2-methylcyclopropane-1-carboxamide
SYSTEMATIC NAME: (1R,2R)-N-(3,4-dimethylphenyl)-2-methyl-cyclopropane-1-carboxamide
MOLECULAR FORMULA: C13H17NO
MOLECULAR WEIGHT: 203.28018
SMILES: C[C@@H]1C[C@H]1C(=O)NC2=CC(=C(C=C2)C)C
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Product OPENEYE NAME: methyl 6-[[(E)-(2-oxo-1-propyl-indolin-3-ylidene)amino]carbamothioylamino]hexanoate
CAS Name: 6-[[[(2E)-2-(2-oxo-1-propyl-3-indolylidene)hydrazinyl]-sulfanylidenemethyl]amino]hexanoic acid methyl ester
IUPAC NAME: methyl 6-[[(E)-(2-oxo-1-propylindol-3-ylidene)amino]carbamothioylamino]hexanoate
SYSTEMATIC NAME: methyl 6-[[(E)-(2-oxidanylidene-1-propyl-indol-3-ylidene)amino]carbamothioylamino]hexanoate
MOLECULAR FORMULA: C19H26N4O3S
MOLECULAR WEIGHT: 390.49974
SMILES: CCCN1C2=CC=CC=C2/C(=N\NC(=S)NCCCCCC(=O)OC)/C1=O
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All Chemical Compounds Information

Product OPENEYE NAME: 1-(3-morpholin-4-ium-4-ylpropyl)-3-[(E)-(2-oxo-1-propyl-indolin-3-ylidene)amino]thiourea
CAS Name: 1-[3-(4-morpholin-4-iumyl)propyl]-3-[(E)-(2-oxo-1-propyl-3-indolylidene)amino]thiourea
IUPAC NAME: 1-(3-morpholin-4-ium-4-ylpropyl)-3-[(E)-(2-oxo-1-propylindol-3-ylidene)amino]thiourea
SYSTEMATIC NAME: 1-(3-morpholin-4-ium-4-ylpropyl)-3-[(E)-(2-oxidanylidene-1-propyl-indol-3-ylidene)amino]thiourea
MOLECULAR FORMULA: C19H28N5O2S+
MOLECULAR WEIGHT: 390.52292
SMILES: CCCN1C2=CC=CC=C2/C(=N\NC(=S)NCCC[NH+]3CCOCC3)/C1=O
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Product OPENEYE NAME: 1-(3-morpholinopropyl)-3-[(E)-(2-oxo-1-propyl-indolin-3-ylidene)amino]thiourea
CAS Name: 1-[3-(4-morpholinyl)propyl]-3-[(E)-(2-oxo-1-propyl-3-indolylidene)amino]thiourea
IUPAC NAME: 1-(3-morpholin-4-ylpropyl)-3-[(E)-(2-oxo-1-propylindol-3-ylidene)amino]thiourea
SYSTEMATIC NAME: 1-(3-morpholin-4-ylpropyl)-3-[(E)-(2-oxidanylidene-1-propyl-indol-3-ylidene)amino]thiourea
MOLECULAR FORMULA: C19H27N5O2S
MOLECULAR WEIGHT: 389.51498
SMILES: CCCN1C2=CC=CC=C2/C(=N\NC(=S)NCCCN3CCOCC3)/C1=O
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Product OPENEYE NAME: 5-[[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole
CAS Name: 5-[[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]methyl]-3-phenyl-1,2,4-oxadiazole
IUPAC NAME: 5-[[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole
SYSTEMATIC NAME: 5-[[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole
MOLECULAR FORMULA: C19H20ClN4O3S+
MOLECULAR WEIGHT: 419.9051
SMILES: C1CN(CC[NH+]1CC2=NC(=NO2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)Cl
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Product OPENEYE NAME: 5-[[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole
CAS Name: 5-[[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]methyl]-3-phenyl-1,2,4-oxadiazole
IUPAC NAME: 5-[[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole
SYSTEMATIC NAME: 5-[[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]methyl]-3-phenyl-1,2,4-oxadiazole
MOLECULAR FORMULA: C19H19ClN4O3S
MOLECULAR WEIGHT: 418.89716
SMILES: C1CN(CCN1CC2=NC(=NO2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)Cl
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Product OPENEYE NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2-(4-nitrophenyl)sulfanyl-acetamide
CAS Name: N-[2-[(2-fluorophenyl)methylthio]ethyl]-2-[(4-nitrophenyl)thio]acetamide
IUPAC NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2-(4-nitrophenyl)sulfanylacetamide
SYSTEMATIC NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-2-(4-nitrophenyl)sulfanyl-ethanamide
MOLECULAR FORMULA: C17H17FN2O3S2
MOLECULAR WEIGHT: 380.456883
SMILES: C1=CC=C(C(=C1)CSCCNC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-])F
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Product OPENEYE NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(cyclopropylcarbamoyl)acetamide
CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]-N-[(cyclopropylamino)-oxomethyl]acetamide
IUPAC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(cyclopropylcarbamoyl)acetamide
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(cyclopropylcarbamoyl)ethanamide
MOLECULAR FORMULA: C16H22ClN4O4S+
MOLECULAR WEIGHT: 401.88828
SMILES: C1CC1NC(=O)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(cyclopropylcarbamoyl)acetamide
CAS Name: 2-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-N-[(cyclopropylamino)-oxomethyl]acetamide
IUPAC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(cyclopropylcarbamoyl)acetamide
SYSTEMATIC NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-(cyclopropylcarbamoyl)ethanamide
MOLECULAR FORMULA: C16H21ClN4O4S
MOLECULAR WEIGHT: 400.88034
SMILES: C1CC1NC(=O)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: [2-[methyl-[2-(4-methylanilino)-2-oxo-ethyl]amino]-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-[methyl-[2-(4-methylanilino)-2-oxoethyl]amino]-2-oxoethyl] ester
IUPAC NAME: [2-[methyl-[2-(4-methylanilino)-2-oxoethyl]amino]-2-oxoethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [2-[methyl-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]amino]-2-oxidanylidene-ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C22H22N2O5
MOLECULAR WEIGHT: 394.42048
SMILES: CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)COC(=O)C2=CC3=CC=CC=C3OC2
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Product OPENEYE NAME: [(1R)-2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-methyl-2-oxo-ethyl] 2-ethyl-3-methyl-quinoline-4-carboxylate
CAS Name: 2-ethyl-3-methyl-4-quinolinecarboxylic acid [(2R)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2R)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxopropan-2-yl] 2-ethyl-3-methylquinoline-4-carboxylate
SYSTEMATIC NAME: [(2R)-1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxidanylidene-propan-2-yl] 2-ethyl-3-methyl-quinoline-4-carboxylate
MOLECULAR FORMULA: C24H26N2O4
MOLECULAR WEIGHT: 406.47424
SMILES: CCC1=NC2=CC=CC=C2C(=C1C)C(=O)O[C@H](C)C(=O)C3=C(C(=C(N3)C)C(=O)C)C
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Product OPENEYE NAME: 1-[(E)-(2-oxo-1-propyl-indolin-3-ylidene)amino]-3-[[(2S)-tetrahydrofuran-2-yl]methyl]thiourea
CAS Name: 1-[[(2S)-2-oxolanyl]methyl]-3-[(E)-(2-oxo-1-propyl-3-indolylidene)amino]thiourea
IUPAC NAME: 1-[[(2S)-oxolan-2-yl]methyl]-3-[(E)-(2-oxo-1-propylindol-3-ylidene)amino]thiourea
SYSTEMATIC NAME: 1-[(E)-(2-oxidanylidene-1-propyl-indol-3-ylidene)amino]-3-[[(2S)-oxolan-2-yl]methyl]thiourea
MOLECULAR FORMULA: C17H22N4O2S
MOLECULAR WEIGHT: 346.44718
SMILES: CCCN1C2=CC=CC=C2/C(=N\NC(=S)NC[C@@H]3CCCO3)/C1=O
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Product OPENEYE NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-(methoxymethyl)benzamide
CAS Name: N-[2-[(2-fluorophenyl)methylthio]ethyl]-4-(methoxymethyl)benzamide
IUPAC NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-(methoxymethyl)benzamide
SYSTEMATIC NAME: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-4-(methoxymethyl)benzamide
MOLECULAR FORMULA: C18H20FNO2S
MOLECULAR WEIGHT: 333.420303
SMILES: COCC1=CC=C(C=C1)C(=O)NCCSCC2=CC=CC=C2F
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Product OPENEYE NAME: 2-chloro-N-(3,4-dimethylphenyl)-5-morpholinosulfonyl-benzamide
CAS Name: 2-chloro-N-(3,4-dimethylphenyl)-5-(4-morpholinylsulfonyl)benzamide
IUPAC NAME: 2-chloro-N-(3,4-dimethylphenyl)-5-morpholin-4-ylsulfonylbenzamide
SYSTEMATIC NAME: 2-chloranyl-N-(3,4-dimethylphenyl)-5-morpholin-4-ylsulfonyl-benzamide
MOLECULAR FORMULA: C19H21ClN2O4S
MOLECULAR WEIGHT: 408.89904
SMILES: CC1=C(C=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)Cl)C
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Product OPENEYE NAME: 1-[(E)-(2-oxo-1-propyl-indolin-3-ylidene)amino]-3-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea
CAS Name: 1-[[(2R)-2-oxolanyl]methyl]-3-[(E)-(2-oxo-1-propyl-3-indolylidene)amino]thiourea
IUPAC NAME: 1-[[(2R)-oxolan-2-yl]methyl]-3-[(E)-(2-oxo-1-propylindol-3-ylidene)amino]thiourea
SYSTEMATIC NAME: 1-[(E)-(2-oxidanylidene-1-propyl-indol-3-ylidene)amino]-3-[[(2R)-oxolan-2-yl]methyl]thiourea
MOLECULAR FORMULA: C17H22N4O2S
MOLECULAR WEIGHT: 346.44718
SMILES: CCCN1C2=CC=CC=C2/C(=N\NC(=S)NC[C@H]3CCCO3)/C1=O
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Product OPENEYE NAME: N-(3,4-dimethylphenyl)-3-pyrrolidin-1-ylsulfonyl-benzamide
CAS Name: N-(3,4-dimethylphenyl)-3-(1-pyrrolidinylsulfonyl)benzamide
IUPAC NAME: N-(3,4-dimethylphenyl)-3-pyrrolidin-1-ylsulfonylbenzamide
SYSTEMATIC NAME: N-(3,4-dimethylphenyl)-3-pyrrolidin-1-ylsulfonyl-benzamide
MOLECULAR FORMULA: C19H22N2O3S
MOLECULAR WEIGHT: 358.45458
SMILES: CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3)C
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Product OPENEYE NAME: 3-[[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]benzonitrile
CAS Name: 3-[[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]methyl]benzonitrile
IUPAC NAME: 3-[[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]benzonitrile
SYSTEMATIC NAME: 3-[[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]benzenecarbonitrile
MOLECULAR FORMULA: C18H19ClN3O2S+
MOLECULAR WEIGHT: 376.88036
SMILES: C1CN(CC[NH+]1CC2=CC=CC(=C2)C#N)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 3-[[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]methyl]benzonitrile
CAS Name: 3-[[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]methyl]benzonitrile
IUPAC NAME: 3-[[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]methyl]benzonitrile
SYSTEMATIC NAME: 3-[[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]methyl]benzenecarbonitrile
MOLECULAR FORMULA: C18H18ClN3O2S
MOLECULAR WEIGHT: 375.87242
SMILES: C1CN(CCN1CC2=CC=CC(=C2)C#N)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: 2-(3,4-dichlorophenyl)-N-(3,4-dimethylphenyl)acetamide
CAS Name: 2-(3,4-dichlorophenyl)-N-(3,4-dimethylphenyl)acetamide
IUPAC NAME: 2-(3,4-dichlorophenyl)-N-(3,4-dimethylphenyl)acetamide
SYSTEMATIC NAME: 2-(3,4-dichlorophenyl)-N-(3,4-dimethylphenyl)ethanamide
MOLECULAR FORMULA: C16H15Cl2NO
MOLECULAR WEIGHT: 308.2024
SMILES: CC1=C(C=C(C=C1)NC(=O)CC2=CC(=C(C=C2)Cl)Cl)C
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Product OPENEYE NAME: 1-cyclopropyl-3-[(Z)-(2-oxo-1-propyl-indolin-3-ylidene)amino]thiourea
CAS Name: 1-cyclopropyl-3-[(Z)-(2-oxo-1-propyl-3-indolylidene)amino]thiourea
IUPAC NAME: 1-cyclopropyl-3-[(Z)-(2-oxo-1-propylindol-3-ylidene)amino]thiourea
SYSTEMATIC NAME: 1-cyclopropyl-3-[(Z)-(2-oxidanylidene-1-propyl-indol-3-ylidene)amino]thiourea
MOLECULAR FORMULA: C15H18N4OS
MOLECULAR WEIGHT: 302.39462
SMILES: CCCN1C2=CC=CC=C2/C(=N/NC(=S)NC3CC3)/C1=O
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Product OPENEYE NAME: methyl 4-[[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]benzoate
CAS Name: 4-[[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]methyl]benzoic acid methyl ester
IUPAC NAME: methyl 4-[[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]benzoate
SYSTEMATIC NAME: methyl 4-[[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]benzoate
MOLECULAR FORMULA: C19H22ClN2O4S+
MOLECULAR WEIGHT: 409.90698
SMILES: COC(=O)C1=CC=C(C=C1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: methyl 4-[[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]methyl]benzoate
CAS Name: 4-[[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]methyl]benzoic acid methyl ester
IUPAC NAME: methyl 4-[[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]methyl]benzoate
SYSTEMATIC NAME: methyl 4-[[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]methyl]benzoate
MOLECULAR FORMULA: C19H21ClN2O4S
MOLECULAR WEIGHT: 408.89904
SMILES: COC(=O)C1=CC=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: [2-oxo-2-(2-oxooxazolidin-3-yl)ethyl] 2-ethyl-3-methyl-quinoline-4-carboxylate
CAS Name: 2-ethyl-3-methyl-4-quinolinecarboxylic acid [2-oxo-2-(2-oxo-3-oxazolidinyl)ethyl] ester
IUPAC NAME: [2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl] 2-ethyl-3-methylquinoline-4-carboxylate
SYSTEMATIC NAME: [2-oxidanylidene-2-(2-oxidanylidene-1,3-oxazolidin-3-yl)ethyl] 2-ethyl-3-methyl-quinoline-4-carboxylate
MOLECULAR FORMULA: C18H18N2O5
MOLECULAR WEIGHT: 342.34592
SMILES: CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCC(=O)N3CCOC3=O
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Product OPENEYE NAME: [(1S)-2-[2-(cyclohexen-1-yl)ethylamino]-1-methyl-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [(2S)-1-[2-(1-cyclohexenyl)ethylamino]-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-[2-(cyclohexen-1-yl)ethylamino]-1-oxopropan-2-yl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [(2S)-1-[2-(cyclohexen-1-yl)ethylamino]-1-oxidanylidene-propan-2-yl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C21H25NO4
MOLECULAR WEIGHT: 355.4275
SMILES: C[C@@H](C(=O)NCCC1=CCCCC1)OC(=O)C2=CC3=CC=CC=C3OC2
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All Chemical Compounds Information

Product OPENEYE NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]-N-[[(1S)-1-methylpropyl]carbamoyl]acetamide
CAS Name: N-[[[(2S)-butan-2-yl]amino]-oxomethyl]-2-[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]acetamide
IUPAC NAME: N-[[(2S)-butan-2-yl]carbamoyl]-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]acetamide
SYSTEMATIC NAME: N-[[(2S)-butan-2-yl]carbamoyl]-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide
MOLECULAR FORMULA: C17H26ClN4O4S+
MOLECULAR WEIGHT: 417.93074
SMILES: CC[C@H](C)NC(=O)NC(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)Cl
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Product OPENEYE NAME: 2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-N-[[(1S)-1-methylpropyl]carbamoyl]acetamide
CAS Name: N-[[[(2S)-butan-2-yl]amino]-oxomethyl]-2-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]acetamide
IUPAC NAME: N-[[(2S)-butan-2-yl]carbamoyl]-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]acetamide
SYSTEMATIC NAME: N-[[(2S)-butan-2-yl]carbamoyl]-2-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]ethanamide
MOLECULAR FORMULA: C17H25ClN4O4S
MOLECULAR WEIGHT: 416.9228
SMILES: CC[C@H](C)NC(=O)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)Cl
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Product OPENEYE NAME: [(1R)-1-methyl-2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] 2-ethyl-3-methyl-quinoline-4-carboxylate
CAS Name: 2-ethyl-3-methyl-4-quinolinecarboxylic acid [(2R)-1-oxo-1-[(1,3,5-trimethyl-4-pyrazolyl)amino]propan-2-yl] ester
IUPAC NAME: [(2R)-1-oxo-1-[(1,3,5-trimethylpyrazol-4-yl)amino]propan-2-yl] 2-ethyl-3-methylquinoline-4-carboxylate
SYSTEMATIC NAME: [(2R)-1-oxidanylidene-1-[(1,3,5-trimethylpyrazol-4-yl)amino]propan-2-yl] 2-ethyl-3-methyl-quinoline-4-carboxylate
MOLECULAR FORMULA: C22H26N4O3
MOLECULAR WEIGHT: 394.46684
SMILES: CCC1=NC2=CC=CC=C2C(=C1C)C(=O)O[C@H](C)C(=O)NC3=C(N(N=C3C)C)C
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Product OPENEYE NAME: [2-[[(3S)-1,1-dioxothiolan-3-yl]-methyl-amino]-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-[[(3S)-1,1-dioxo-3-thiolanyl]-methylamino]-2-oxoethyl] ester
IUPAC NAME: [2-[[(3S)-1,1-dioxothiolan-3-yl]-methylamino]-2-oxoethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [2-[[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-amino]-2-oxidanylidene-ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C17H19NO6S
MOLECULAR WEIGHT: 365.40086
SMILES: CN([C@H]1CCS(=O)(=O)C1)C(=O)COC(=O)C2=CC3=CC=CC=C3OC2
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Product OPENEYE NAME: 4-ethoxy-N-[2-[2-[(2-fluorophenyl)methylsulfanyl]ethylamino]-2-oxo-ethyl]benzamide
CAS Name: 4-ethoxy-N-[2-[2-[(2-fluorophenyl)methylthio]ethylamino]-2-oxoethyl]benzamide
IUPAC NAME: 4-ethoxy-N-[2-[2-[(2-fluorophenyl)methylsulfanyl]ethylamino]-2-oxoethyl]benzamide
SYSTEMATIC NAME: 4-ethoxy-N-[2-[2-[(2-fluorophenyl)methylsulfanyl]ethylamino]-2-oxidanylidene-ethyl]benzamide
MOLECULAR FORMULA: C20H23FN2O3S
MOLECULAR WEIGHT: 390.471623
SMILES: CCOC1=CC=C(C=C1)C(=O)NCC(=O)NCCSCC2=CC=CC=C2F
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Product OPENEYE NAME: 1-[(Z)-(2-oxo-1-propyl-indolin-3-ylidene)amino]-3-propyl-thiourea
CAS Name: 1-[(Z)-(2-oxo-1-propyl-3-indolylidene)amino]-3-propylthiourea
IUPAC NAME: 1-[(Z)-(2-oxo-1-propylindol-3-ylidene)amino]-3-propylthiourea
SYSTEMATIC NAME: 1-[(Z)-(2-oxidanylidene-1-propyl-indol-3-ylidene)amino]-3-propyl-thiourea
MOLECULAR FORMULA: C15H20N4OS
MOLECULAR WEIGHT: 304.4105
SMILES: CCCNC(=S)N/N=C\1/C2=CC=CC=C2N(C1=O)CCC
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Product OPENEYE NAME: methyl 3-[[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]benzoate
CAS Name: 3-[[4-(4-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]methyl]benzoic acid methyl ester
IUPAC NAME: methyl 3-[[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]benzoate
SYSTEMATIC NAME: methyl 3-[[4-(4-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]benzoate
MOLECULAR FORMULA: C19H22ClN2O4S+
MOLECULAR WEIGHT: 409.90698
SMILES: COC(=O)C1=CC(=CC=C1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: methyl 3-[[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]methyl]benzoate
CAS Name: 3-[[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]methyl]benzoic acid methyl ester
IUPAC NAME: methyl 3-[[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]methyl]benzoate
SYSTEMATIC NAME: methyl 3-[[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]methyl]benzoate
MOLECULAR FORMULA: C19H21ClN2O4S
MOLECULAR WEIGHT: 408.89904
SMILES: COC(=O)C1=CC(=CC=C1)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: [2-(2-furylmethylcarbamoylamino)-2-oxo-ethyl] 2H-chromene-3-carboxylate
CAS Name: 2H-1-benzopyran-3-carboxylic acid [2-[[(2-furanylmethylamino)-oxomethyl]amino]-2-oxoethyl] ester
IUPAC NAME: [2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl] 2H-chromene-3-carboxylate
SYSTEMATIC NAME: [2-(furan-2-ylmethylcarbamoylamino)-2-oxidanylidene-ethyl] 2H-chromene-3-carboxylate
MOLECULAR FORMULA: C18H16N2O6
MOLECULAR WEIGHT: 356.32944
SMILES: C1C(=CC2=CC=CC=C2O1)C(=O)OCC(=O)NC(=O)NCC3=CC=CO3
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Product OPENEYE NAME: [(1S)-2-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-methyl-2-oxo-ethyl] 2-ethyl-3-methyl-quinoline-4-carboxylate
CAS Name: 2-ethyl-3-methyl-4-quinolinecarboxylic acid [(2S)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxopropan-2-yl] ester
IUPAC NAME: [(2S)-1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxopropan-2-yl] 2-ethyl-3-methylquinoline-4-carboxylate
SYSTEMATIC NAME: [(2S)-1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-1-oxidanylidene-propan-2-yl] 2-ethyl-3-methyl-quinoline-4-carboxylate
MOLECULAR FORMULA: C24H26N2O4
MOLECULAR WEIGHT: 406.47424
SMILES: CCC1=NC2=CC=CC=C2C(=C1C)C(=O)O[C@@H](C)C(=O)C3=C(C(=C(N3)C)C(=O)C)C
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Product OPENEYE NAME: N-(3,4-dimethylphenyl)-4-(trifluoromethyl)benzamide
CAS Name: N-(3,4-dimethylphenyl)-4-(trifluoromethyl)benzamide
IUPAC NAME: N-(3,4-dimethylphenyl)-4-(trifluoromethyl)benzamide
SYSTEMATIC NAME: N-(3,4-dimethylphenyl)-4-(trifluoromethyl)benzamide
MOLECULAR FORMULA: C16H14F3NO
MOLECULAR WEIGHT: 293.28367
SMILES: CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)C(F)(F)F)C
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