Thursday, November 29, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 1-(5-anilino-4-nitro-2-thienyl)ethanone
CAS Name: 1-(5-anilino-4-nitro-2-thiophenyl)ethanone
IUPAC NAME: 1-(5-anilino-4-nitrothiophen-2-yl)ethanone
SYSTEMATIC NAME: 1-(4-nitro-5-phenylazanyl-thiophen-2-yl)ethanone
MOLECULAR FORMULA: C12H10N2O3S
MOLECULAR WEIGHT: 262.2844
SMILES: CC(=O)C1=CC(=C(S1)NC2=CC=CC=C2)[N+](=O)[O-]
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Product OPENEYE NAME: 3-(5-bromo-2-thienyl)-1-(4-chlorophenyl)sulfonyl-pyrazole
CAS Name: 3-(5-bromo-2-thiophenyl)-1-(4-chlorophenyl)sulfonylpyrazole
IUPAC NAME: 3-(5-bromothiophen-2-yl)-1-(4-chlorophenyl)sulfonylpyrazole
SYSTEMATIC NAME: 3-(5-bromanylthiophen-2-yl)-1-(4-chlorophenyl)sulfonyl-pyrazole
MOLECULAR FORMULA: C13H8BrClN2O2S2
MOLECULAR WEIGHT: 403.70182
SMILES: C1=CC(=CC=C1S(=O)(=O)N2C=CC(=N2)C3=CC=C(S3)Br)Cl
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Product OPENEYE NAME: 1-[5-(4-methoxyanilino)-4-nitro-2-thienyl]ethanone
CAS Name: 1-[5-(4-methoxyanilino)-4-nitro-2-thiophenyl]ethanone
IUPAC NAME: 1-[5-(4-methoxyanilino)-4-nitrothiophen-2-yl]ethanone
SYSTEMATIC NAME: 1-[5-[(4-methoxyphenyl)amino]-4-nitro-thiophen-2-yl]ethanone
MOLECULAR FORMULA: C13H12N2O4S
MOLECULAR WEIGHT: 292.31038
SMILES: CC(=O)C1=CC(=C(S1)NC2=CC=C(C=C2)OC)[N+](=O)[O-]
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Product OPENEYE NAME: 1-[5-(4-chloroanilino)-4-nitro-2-thienyl]ethanone
CAS Name: 1-[5-(4-chloroanilino)-4-nitro-2-thiophenyl]ethanone
IUPAC NAME: 1-[5-(4-chloroanilino)-4-nitrothiophen-2-yl]ethanone
SYSTEMATIC NAME: 1-[5-[(4-chlorophenyl)amino]-4-nitro-thiophen-2-yl]ethanone
MOLECULAR FORMULA: C12H9ClN2O3S
MOLECULAR WEIGHT: 296.72946
SMILES: CC(=O)C1=CC(=C(S1)NC2=CC=C(C=C2)Cl)[N+](=O)[O-]
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Product OPENEYE NAME: N-(1-benzyl-4-piperidyl)-2,1,3-benzothiadiazole-4-sulfonamide
CAS Name: N-[1-(phenylmethyl)-4-piperidinyl]-2,1,3-benzothiadiazole-4-sulfonamide
IUPAC NAME: N-(1-benzylpiperidin-4-yl)-2,1,3-benzothiadiazole-4-sulfonamide
SYSTEMATIC NAME: N-[1-(phenylmethyl)piperidin-4-yl]-2,1,3-benzothiadiazole-4-sulfonamide
MOLECULAR FORMULA: C18H20N4O2S2
MOLECULAR WEIGHT: 388.507
SMILES: C1CN(CCC1NS(=O)(=O)C2=CC=CC3=NSN=C32)CC4=CC=CC=C4
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Product OPENEYE NAME: 1-(benzenesulfonyl)-3-(5-bromo-2-thienyl)pyrazole
CAS Name: 1-(benzenesulfonyl)-3-(5-bromo-2-thiophenyl)pyrazole
IUPAC NAME: 1-(benzenesulfonyl)-3-(5-bromothiophen-2-yl)pyrazole
SYSTEMATIC NAME: 3-(5-bromanylthiophen-2-yl)-1-(phenylsulfonyl)pyrazole
MOLECULAR FORMULA: C13H9BrN2O2S2
MOLECULAR WEIGHT: 369.25676
SMILES: C1=CC=C(C=C1)S(=O)(=O)N2C=CC(=N2)C3=CC=C(S3)Br
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Product OPENEYE NAME: (E)-3-[(1-benzyl-4-piperidyl)amino]-2-(4-methoxybenzoyl)prop-2-enenitrile
CAS Name: (E)-2-[(4-methoxyphenyl)-oxomethyl]-3-[[1-(phenylmethyl)-4-piperidinyl]amino]-2-propenenitrile
IUPAC NAME: (E)-3-[(1-benzylpiperidin-4-yl)amino]-2-(4-methoxybenzoyl)prop-2-enenitrile
SYSTEMATIC NAME: (E)-2-(4-methoxyphenyl)carbonyl-3-[[1-(phenylmethyl)piperidin-4-yl]amino]prop-2-enenitrile
MOLECULAR FORMULA: C23H25N3O2
MOLECULAR WEIGHT: 375.4635
SMILES: COC1=CC=C(C=C1)C(=O)/C(=C/NC2CCN(CC2)CC3=CC=CC=C3)/C#N
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Product OPENEYE NAME: 2-[3-[4-(3-chlorophenyl)piperazin-1-yl]propylsulfanyl]acetohydrazide
CAS Name: 2-[3-[4-(3-chlorophenyl)-1-piperazinyl]propylthio]acetohydrazide
IUPAC NAME: 2-[3-[4-(3-chlorophenyl)piperazin-1-yl]propylsulfanyl]acetohydrazide
SYSTEMATIC NAME: 2-[3-[4-(3-chlorophenyl)piperazin-1-yl]propylsulfanyl]ethanehydrazide
MOLECULAR FORMULA: C15H23ClN4OS
MOLECULAR WEIGHT: 342.88732
SMILES: C1CN(CCN1CCCSCC(=O)NN)C2=CC(=CC=C2)Cl
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Product OPENEYE NAME: methyl 3-[[5-(2-methylsulfanylpyrimidin-4-yl)-2-thienyl]sulfonylamino]thiophene-2-carboxylate
CAS Name: 3-[[5-[2-(methylthio)-4-pyrimidinyl]-2-thiophenyl]sulfonylamino]-2-thiophenecarboxylic acid methyl ester
IUPAC NAME: methyl 3-[[5-(2-methylsulfanylpyrimidin-4-yl)thiophen-2-yl]sulfonylamino]thiophene-2-carboxylate
SYSTEMATIC NAME: methyl 3-[[5-(2-methylsulfanylpyrimidin-4-yl)thiophen-2-yl]sulfonylamino]thiophene-2-carboxylate
MOLECULAR FORMULA: C15H13N3O4S4
MOLECULAR WEIGHT: 427.54142
SMILES: COC(=O)C1=C(C=CS1)NS(=O)(=O)C2=CC=C(S2)C3=NC(=NC=C3)SC
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Product OPENEYE NAME: [[1-amino-2-(4-fluorophenyl)sulfonyl-ethylidene]amino] N-(3,5-dichlorophenyl)carbamate
CAS Name: N-(3,5-dichlorophenyl)carbamic acid [[1-amino-2-(4-fluorophenyl)sulfonylethylidene]amino] ester
IUPAC NAME: [[1-amino-2-(4-fluorophenyl)sulfonylethylidene]amino] N-(3,5-dichlorophenyl)carbamate
SYSTEMATIC NAME: [[1-azanyl-2-(4-fluorophenyl)sulfonyl-ethylidene]amino] N-[3,5-bis(chloranyl)phenyl]carbamate
MOLECULAR FORMULA: C15H12Cl2FN3O4S
MOLECULAR WEIGHT: 420.242883
SMILES: C1=CC(=CC=C1F)S(=O)(=O)CC(=NOC(=O)NC2=CC(=CC(=C2)Cl)Cl)N
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Product OPENEYE NAME: ethyl 4,5-dimethyl-3-[[5-(2-methylsulfanylpyrimidin-4-yl)-2-thienyl]sulfonylamino]thiophene-2-carboxylate
CAS Name: 4,5-dimethyl-3-[[5-[2-(methylthio)-4-pyrimidinyl]-2-thiophenyl]sulfonylamino]-2-thiophenecarboxylic acid ethyl ester
IUPAC NAME: ethyl 4,5-dimethyl-3-[[5-(2-methylsulfanylpyrimidin-4-yl)thiophen-2-yl]sulfonylamino]thiophene-2-carboxylate
SYSTEMATIC NAME: ethyl 4,5-dimethyl-3-[[5-(2-methylsulfanylpyrimidin-4-yl)thiophen-2-yl]sulfonylamino]thiophene-2-carboxylate
MOLECULAR FORMULA: C18H19N3O4S4
MOLECULAR WEIGHT: 469.62116
SMILES: CCOC(=O)C1=C(C(=C(S1)C)C)NS(=O)(=O)C2=CC=C(S2)C3=NC(=NC=C3)SC
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Product OPENEYE NAME: [[1-amino-2-(4-fluorophenyl)sulfonyl-ethylidene]amino] N-(4-chlorophenyl)carbamate
CAS Name: N-(4-chlorophenyl)carbamic acid [[1-amino-2-(4-fluorophenyl)sulfonylethylidene]amino] ester
IUPAC NAME: [[1-amino-2-(4-fluorophenyl)sulfonylethylidene]amino] N-(4-chlorophenyl)carbamate
SYSTEMATIC NAME: [[1-azanyl-2-(4-fluorophenyl)sulfonyl-ethylidene]amino] N-(4-chlorophenyl)carbamate
MOLECULAR FORMULA: C15H13ClFN3O4S
MOLECULAR WEIGHT: 385.797823
SMILES: C1=CC(=CC=C1NC(=O)ON=C(CS(=O)(=O)C2=CC=C(C=C2)F)N)Cl
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Product OPENEYE NAME: 2-(4-fluorophenyl)sulfonyl-N'-[4-(trifluoromethoxy)anilino]oxy-acetamidine
CAS Name: 2-(4-fluorophenyl)sulfonyl-N'-[4-(trifluoromethoxy)anilino]oxyethanimidamide
IUPAC NAME: 2-(4-fluorophenyl)sulfonyl-N'-[4-(trifluoromethoxy)anilino]oxyethanimidamide
SYSTEMATIC NAME: 2-(4-fluorophenyl)sulfonyl-N'-[[4-(trifluoromethyloxy)phenyl]amino]oxy-ethanimidamide
MOLECULAR FORMULA: C15H13F4N3O4S
MOLECULAR WEIGHT: 407.340033
SMILES: C1=CC(=CC=C1NON=C(CS(=O)(=O)C2=CC=C(C=C2)F)N)OC(F)(F)F
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Product OPENEYE NAME: (3-phenoxy-2-thienyl)methyl 4-chlorobenzoate
CAS Name: 4-chlorobenzoic acid (3-phenoxy-2-thiophenyl)methyl ester
IUPAC NAME: (3-phenoxythiophen-2-yl)methyl 4-chlorobenzoate
SYSTEMATIC NAME: (3-phenoxythiophen-2-yl)methyl 4-chloranylbenzoate
MOLECULAR FORMULA: C18H13ClO3S
MOLECULAR WEIGHT: 344.81202
SMILES: C1=CC=C(C=C1)OC2=C(SC=C2)COC(=O)C3=CC=C(C=C3)Cl
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Product OPENEYE NAME: [[1-amino-2-(4-fluorophenyl)sulfonyl-ethylidene]amino] 4-chlorobenzoate
CAS Name: 4-chlorobenzoic acid [[1-amino-2-(4-fluorophenyl)sulfonylethylidene]amino] ester
IUPAC NAME: [[1-amino-2-(4-fluorophenyl)sulfonylethylidene]amino] 4-chlorobenzoate
SYSTEMATIC NAME: [[1-azanyl-2-(4-fluorophenyl)sulfonyl-ethylidene]amino] 4-chloranylbenzoate
MOLECULAR FORMULA: C15H12ClFN2O4S
MOLECULAR WEIGHT: 370.783183
SMILES: C1=CC(=CC=C1C(=O)ON=C(CS(=O)(=O)C2=CC=C(C=C2)F)N)Cl
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