Thursday, October 25, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 4-[(2-methylpyrazol-3-yl)amino]-4-oxo-but-2-enoic acid
CAS Name: 4-[(2-methyl-3-pyrazolyl)amino]-4-oxo-2-butenoic acid
IUPAC NAME: 4-[(2-methylpyrazol-3-yl)amino]-4-oxobut-2-enoic acid
SYSTEMATIC NAME: 4-[(2-methylpyrazol-3-yl)amino]-4-oxidanylidene-but-2-enoic acid
MOLECULAR FORMULA: C8H9N3O3
MOLECULAR WEIGHT: 195.17536
SMILES: CN1C(=CC=N1)NC(=O)C=CC(=O)O
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Product OPENEYE NAME: 1-(4-chlorophenyl)-3-(2-methylpyrazol-3-yl)thiourea
CAS Name: 1-(4-chlorophenyl)-3-(2-methyl-3-pyrazolyl)thiourea
IUPAC NAME: 1-(4-chlorophenyl)-3-(2-methylpyrazol-3-yl)thiourea
SYSTEMATIC NAME: 1-(4-chlorophenyl)-3-(2-methylpyrazol-3-yl)thiourea
MOLECULAR FORMULA: C11H11ClN4S
MOLECULAR WEIGHT: 266.74984
SMILES: CN1C(=CC=N1)NC(=S)NC2=CC=C(C=C2)Cl
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Product OPENEYE NAME: methyl 3-[2-[(1-phenyl-5-propyl-pyrazole-4-carbonyl)amino]-4-(trifluoromethyl)phenoxy]thiophene-2-carboxylate
CAS Name: 3-[2-[[oxo-(1-phenyl-5-propyl-4-pyrazolyl)methyl]amino]-4-(trifluoromethyl)phenoxy]-2-thiophenecarboxylic acid methyl ester
IUPAC NAME: methyl 3-[2-[(1-phenyl-5-propylpyrazole-4-carbonyl)amino]-4-(trifluoromethyl)phenoxy]thiophene-2-carboxylate
SYSTEMATIC NAME: methyl 3-[2-[(1-phenyl-5-propyl-pyrazol-4-yl)carbonylamino]-4-(trifluoromethyl)phenoxy]thiophene-2-carboxylate
MOLECULAR FORMULA: C26H22F3N3O4S
MOLECULAR WEIGHT: 529.53079
SMILES: CCCC1=C(C=NN1C2=CC=CC=C2)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)OC4=C(SC=C4)C(=O)OC
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Product OPENEYE NAME: 2,6-dichloro-N-[(2-methylpyrazol-3-yl)carbamoyl]benzamide
CAS Name: 2,6-dichloro-N-[[(2-methyl-3-pyrazolyl)amino]-oxomethyl]benzamide
IUPAC NAME: 2,6-dichloro-N-[(2-methylpyrazol-3-yl)carbamoyl]benzamide
SYSTEMATIC NAME: 2,6-bis(chloranyl)-N-[(2-methylpyrazol-3-yl)carbamoyl]benzamide
MOLECULAR FORMULA: C12H10Cl2N4O2
MOLECULAR WEIGHT: 313.1394
SMILES: CN1C(=CC=N1)NC(=O)NC(=O)C2=C(C=CC=C2Cl)Cl
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Product OPENEYE NAME: 1-(4-ethoxyphenyl)-3-[2-(3-thienyl)vinyl]urea
CAS Name: 1-(4-ethoxyphenyl)-3-[2-(3-thiophenyl)ethenyl]urea
IUPAC NAME: 1-(4-ethoxyphenyl)-3-(2-thiophen-3-ylethenyl)urea
SYSTEMATIC NAME: 1-(4-ethoxyphenyl)-3-(2-thiophen-3-ylethenyl)urea
MOLECULAR FORMULA: C15H16N2O2S
MOLECULAR WEIGHT: 288.36474
SMILES: CCOC1=CC=C(C=C1)NC(=O)NC=CC2=CSC=C2
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Product OPENEYE NAME: 2,6-difluoro-N-[(2-methylpyrazol-3-yl)carbamoyl]benzamide
CAS Name: 2,6-difluoro-N-[[(2-methyl-3-pyrazolyl)amino]-oxomethyl]benzamide
IUPAC NAME: 2,6-difluoro-N-[(2-methylpyrazol-3-yl)carbamoyl]benzamide
SYSTEMATIC NAME: 2,6-bis(fluoranyl)-N-[(2-methylpyrazol-3-yl)carbamoyl]benzamide
MOLECULAR FORMULA: C12H10F2N4O2
MOLECULAR WEIGHT: 280.230206
SMILES: CN1C(=CC=N1)NC(=O)NC(=O)C2=C(C=CC=C2F)F
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Product OPENEYE NAME: 1-(p-tolyl)-3-[2-(3-thienyl)vinyl]urea
CAS Name: 1-(4-methylphenyl)-3-[2-(3-thiophenyl)ethenyl]urea
IUPAC NAME: 1-(4-methylphenyl)-3-(2-thiophen-3-ylethenyl)urea
SYSTEMATIC NAME: 1-(4-methylphenyl)-3-(2-thiophen-3-ylethenyl)urea
MOLECULAR FORMULA: C14H14N2OS
MOLECULAR WEIGHT: 258.33876
SMILES: CC1=CC=C(C=C1)NC(=O)NC=CC2=CSC=C2
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Product OPENEYE NAME: 1-(5-chloro-2-fluoro-phenyl)-3-[2-(3-thienyl)vinyl]urea
CAS Name: 1-(5-chloro-2-fluorophenyl)-3-[2-(3-thiophenyl)ethenyl]urea
IUPAC NAME: 1-(5-chloro-2-fluorophenyl)-3-(2-thiophen-3-ylethenyl)urea
SYSTEMATIC NAME: 1-(5-chloranyl-2-fluoranyl-phenyl)-3-(2-thiophen-3-ylethenyl)urea
MOLECULAR FORMULA: C13H10ClFN2OS
MOLECULAR WEIGHT: 296.747703
SMILES: C1=CC(=C(C=C1Cl)NC(=O)NC=CC2=CSC=C2)F
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Product OPENEYE NAME: N-(1-benzyl-4-piperidyl)-7-methyl-thieno[3,2-d]pyrimidin-4-amine
CAS Name: 7-methyl-N-[1-(phenylmethyl)-4-piperidinyl]-4-thieno[3,2-d]pyrimidinamine
IUPAC NAME: N-(1-benzylpiperidin-4-yl)-7-methylthieno[3,2-d]pyrimidin-4-amine
SYSTEMATIC NAME: 7-methyl-N-[1-(phenylmethyl)piperidin-4-yl]thieno[3,2-d]pyrimidin-4-amine
MOLECULAR FORMULA: C19H22N4S
MOLECULAR WEIGHT: 338.46978
SMILES: CC1=CSC2=C1N=CN=C2NC3CCN(CC3)CC4=CC=CC=C4
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Product OPENEYE NAME: N-(1-benzyl-4-piperidyl)-5-methyl-thieno[2,3-d]pyrimidin-4-amine
CAS Name: 5-methyl-N-[1-(phenylmethyl)-4-piperidinyl]-4-thieno[2,3-d]pyrimidinamine
IUPAC NAME: N-(1-benzylpiperidin-4-yl)-5-methylthieno[2,3-d]pyrimidin-4-amine
SYSTEMATIC NAME: 5-methyl-N-[1-(phenylmethyl)piperidin-4-yl]thieno[2,3-d]pyrimidin-4-amine
MOLECULAR FORMULA: C19H22N4S
MOLECULAR WEIGHT: 338.46978
SMILES: CC1=CSC2=NC=NC(=C12)NC3CCN(CC3)CC4=CC=CC=C4
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Product OPENEYE NAME: methyl 2-(6,7-dimethoxyquinazolin-4-yl)sulfanylacetate
CAS Name: 2-[(6,7-dimethoxy-4-quinazolinyl)thio]acetic acid methyl ester
IUPAC NAME: methyl 2-(6,7-dimethoxyquinazolin-4-yl)sulfanylacetate
SYSTEMATIC NAME: methyl 2-(6,7-dimethoxyquinazolin-4-yl)sulfanylethanoate
MOLECULAR FORMULA: C13H14N2O4S
MOLECULAR WEIGHT: 294.32626
SMILES: COC1=C(C=C2C(=C1)C(=NC=N2)SCC(=O)OC)OC
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Product OPENEYE NAME: N-[4-[(2-methylpyrazol-3-yl)sulfamoyl]phenyl]-4-(trifluoromethyl)benzenesulfonamide
CAS Name: N-[4-[(2-methyl-3-pyrazolyl)sulfamoyl]phenyl]-4-(trifluoromethyl)benzenesulfonamide
IUPAC NAME: N-[4-[(2-methylpyrazol-3-yl)sulfamoyl]phenyl]-4-(trifluoromethyl)benzenesulfonamide
SYSTEMATIC NAME: N-[4-[(2-methylpyrazol-3-yl)sulfamoyl]phenyl]-4-(trifluoromethyl)benzenesulfonamide
MOLECULAR FORMULA: C17H15F3N4O4S2
MOLECULAR WEIGHT: 460.45061
SMILES: CN1C(=CC=N1)NS(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)C(F)(F)F
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Product OPENEYE NAME: N'-(2,2-dimethylpropanoyl)-2-(2,5-dimethylpyrrol-1-yl)-4,5-dimethoxy-benzohydrazide
CAS Name: N'-(2,2-dimethyl-1-oxopropyl)-2-(2,5-dimethyl-1-pyrrolyl)-4,5-dimethoxybenzohydrazide
IUPAC NAME: N'-(2,2-dimethylpropanoyl)-2-(2,5-dimethylpyrrol-1-yl)-4,5-dimethoxybenzohydrazide
SYSTEMATIC NAME: N'-(2,2-dimethylpropanoyl)-2-(2,5-dimethylpyrrol-1-yl)-4,5-dimethoxy-benzohydrazide
MOLECULAR FORMULA: C20H27N3O4
MOLECULAR WEIGHT: 373.44608
SMILES: CC1=CC=C(N1C2=CC(=C(C=C2C(=O)NNC(=O)C(C)(C)C)OC)OC)C
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Product OPENEYE NAME: N'-benzoyl-2-(2,5-dimethylpyrrol-1-yl)-4,5-dimethoxy-benzohydrazide
CAS Name: N'-benzoyl-2-(2,5-dimethyl-1-pyrrolyl)-4,5-dimethoxybenzohydrazide
IUPAC NAME: N'-benzoyl-2-(2,5-dimethylpyrrol-1-yl)-4,5-dimethoxybenzohydrazide
SYSTEMATIC NAME: 2-(2,5-dimethylpyrrol-1-yl)-4,5-dimethoxy-N'-(phenylcarbonyl)benzohydrazide
MOLECULAR FORMULA: C22H23N3O4
MOLECULAR WEIGHT: 393.43572
SMILES: CC1=CC=C(N1C2=CC(=C(C=C2C(=O)NNC(=O)C3=CC=CC=C3)OC)OC)C
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