Wednesday, May 29, 2013

All Chemical Compounds Information




Product OPENEYE NAME: 1-(4-chlorophenyl)-5-methyl-N-[4-(methylcarbamoylamino)phenyl]pyrazole-4-carboxamide
CAS Name: 1-(4-chlorophenyl)-5-methyl-N-[4-(methylcarbamoylamino)phenyl]-4-pyrazolecarboxamide
IUPAC NAME: 1-(4-chlorophenyl)-5-methyl-N-[4-(methylcarbamoylamino)phenyl]pyrazole-4-carboxamide
SYSTEMATIC NAME: 1-(4-chlorophenyl)-5-methyl-N-[4-(methylcarbamoylamino)phenyl]pyrazole-4-carboxamide
MOLECULAR FORMULA: C19H18ClN5O2
MOLECULAR WEIGHT: 383.83152
SMILES: CC1=C(C=NN1C2=CC=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)NC(=O)NC
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Product OPENEYE NAME: 4-allyloxy-3-methoxy-N-[4-(methylcarbamoylamino)phenyl]benzamide
CAS Name: 3-methoxy-N-[4-(methylcarbamoylamino)phenyl]-4-prop-2-enoxybenzamide
IUPAC NAME: 3-methoxy-N-[4-(methylcarbamoylamino)phenyl]-4-prop-2-enoxybenzamide
SYSTEMATIC NAME: 3-methoxy-N-[4-(methylcarbamoylamino)phenyl]-4-prop-2-enoxy-benzamide
MOLECULAR FORMULA: C19H21N3O4
MOLECULAR WEIGHT: 355.38774
SMILES: CNC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)OCC=C)OC
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Product OPENEYE NAME: [5-(p-tolylcarbamoyl)-1,3,4-thiadiazol-2-yl]methyl (1R)-cyclohex-3-ene-1-carboxylate
CAS Name: (1R)-1-cyclohex-3-enecarboxylic acid [5-[(4-methylanilino)-oxomethyl]-1,3,4-thiadiazol-2-yl]methyl ester
IUPAC NAME: [5-[(4-methylphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl]methyl (1R)-cyclohex-3-ene-1-carboxylate
SYSTEMATIC NAME: [5-[(4-methylphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl]methyl (1R)-cyclohex-3-ene-1-carboxylate
MOLECULAR FORMULA: C18H19N3O3S
MOLECULAR WEIGHT: 357.42676
SMILES: CC1=CC=C(C=C1)NC(=O)C2=NN=C(S2)COC(=O)[C@@H]3CCC=CC3
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Product OPENEYE NAME: [5-(p-tolylcarbamoyl)-1,3,4-thiadiazol-2-yl]methyl (1S)-cyclohex-3-ene-1-carboxylate
CAS Name: (1S)-1-cyclohex-3-enecarboxylic acid [5-[(4-methylanilino)-oxomethyl]-1,3,4-thiadiazol-2-yl]methyl ester
IUPAC NAME: [5-[(4-methylphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl]methyl (1S)-cyclohex-3-ene-1-carboxylate
SYSTEMATIC NAME: [5-[(4-methylphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl]methyl (1S)-cyclohex-3-ene-1-carboxylate
MOLECULAR FORMULA: C18H19N3O3S
MOLECULAR WEIGHT: 357.42676
SMILES: CC1=CC=C(C=C1)NC(=O)C2=NN=C(S2)COC(=O)[C@H]3CCC=CC3
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Product OPENEYE NAME: (4-benzyl-1,4-diazepan-4-ium-1-yl)-(3-phenyl-1H-pyrazol-5-yl)methanone
CAS Name: [4-(phenylmethyl)-1,4-diazepan-4-ium-1-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone
IUPAC NAME: (4-benzyl-1,4-diazepan-4-ium-1-yl)-(3-phenyl-1H-pyrazol-5-yl)methanone
SYSTEMATIC NAME: [4-(phenylmethyl)-1,4-diazepan-4-ium-1-yl]-(3-phenyl-1H-pyrazol-5-yl)methanone
MOLECULAR FORMULA: C22H25N4O+
MOLECULAR WEIGHT: 361.4601
SMILES: C1C[NH+](CCN(C1)C(=O)C2=CC(=NN2)C3=CC=CC=C3)CC4=CC=CC=C4
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Product OPENEYE NAME: O1-ethyl O4-[[5-(p-tolylcarbamoyl)-1,3,4-thiadiazol-2-yl]methyl] (E)-but-2-enedioate
CAS Name: (E)-2-butenedioic acid O1-ethyl ester O4-[[5-[(4-methylanilino)-oxomethyl]-1,3,4-thiadiazol-2-yl]methyl] ester
IUPAC NAME: 1-O-ethyl 4-O-[[5-[(4-methylphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl]methyl] (E)-but-2-enedioate
SYSTEMATIC NAME: O1-ethyl O4-[[5-[(4-methylphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl]methyl] (E)-but-2-enedioate
MOLECULAR FORMULA: C17H17N3O5S
MOLECULAR WEIGHT: 375.39898
SMILES: CCOC(=O)/C=C/C(=O)OCC1=NN=C(S1)C(=O)NC2=CC=C(C=C2)C
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Product OPENEYE NAME: 2-[2,5-dimethyl-3-(2-methylthiazol-4-yl)pyrrol-1-yl]-N-(5-ethyl-6,7-dihydro-4H-thiazolo[5,4-c]pyridin-2-yl)acetamide
CAS Name: 2-[2,5-dimethyl-3-(2-methyl-4-thiazolyl)-1-pyrrolyl]-N-(5-ethyl-6,7-dihydro-4H-thiazolo[5,4-c]pyridin-2-yl)acetamide
IUPAC NAME: 2-[2,5-dimethyl-3-(2-methyl-1,3-thiazol-4-yl)pyrrol-1-yl]-N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide
SYSTEMATIC NAME: 2-[2,5-dimethyl-3-(2-methyl-1,3-thiazol-4-yl)pyrrol-1-yl]-N-(5-ethyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)ethanamide
MOLECULAR FORMULA: C20H25N5OS2
MOLECULAR WEIGHT: 415.5754
SMILES: CCN1CCC2=C(C1)SC(=N2)NC(=O)CN3C(=CC(=C3C)C4=CSC(=N4)C)C
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Product OPENEYE NAME: N-(2-methoxy-5-nitro-phenyl)-3-pyrimidin-2-ylsulfanyl-propanamide
CAS Name: N-(2-methoxy-5-nitrophenyl)-3-(2-pyrimidinylthio)propanamide
IUPAC NAME: N-(2-methoxy-5-nitrophenyl)-3-pyrimidin-2-ylsulfanylpropanamide
SYSTEMATIC NAME: N-(2-methoxy-5-nitro-phenyl)-3-pyrimidin-2-ylsulfanyl-propanamide
MOLECULAR FORMULA: C14H14N4O4S
MOLECULAR WEIGHT: 334.35036
SMILES: COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CCSC2=NC=CC=N2
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Product OPENEYE NAME: N-(6-chloro-1,3-benzothiazol-2-yl)-2-imidazo[1,2-a]pyridin-2-yl-acetamide
CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-2-(2-imidazo[1,2-a]pyridinyl)acetamide
IUPAC NAME: N-(6-chloro-1,3-benzothiazol-2-yl)-2-imidazo[1,2-a]pyridin-2-ylacetamide
SYSTEMATIC NAME: N-(6-chloranyl-1,3-benzothiazol-2-yl)-2-imidazo[1,2-a]pyridin-2-yl-ethanamide
MOLECULAR FORMULA: C16H11ClN4OS
MOLECULAR WEIGHT: 342.80274
SMILES: C1=CC2=NC(=CN2C=C1)CC(=O)NC3=NC4=C(S3)C=C(C=C4)Cl
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