Wednesday, January 30, 2013

All Chemical Compounds Information




Product OPENEYE NAME: N-(5-methyl-1,3,4-thiadiazol-2-yl)quinoline-8-carboxamide
CAS Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-8-quinolinecarboxamide
IUPAC NAME: N-(5-methyl-1,3,4-thiadiazol-2-yl)quinoline-8-carboxamide
SYSTEMATIC NAME: N-(5-methyl-1,3,4-thiadiazol-2-yl)quinoline-8-carboxamide
MOLECULAR FORMULA: C13H10N4OS
MOLECULAR WEIGHT: 270.3097
SMILES: CC1=NN=C(S1)NC(=O)C2=CC=CC3=C2N=CC=C3
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Product OPENEYE NAME: N-(5-methyl-6,7-dihydro-4H-thiazolo[5,4-c]pyridin-2-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
CAS Name: N-(5-methyl-6,7-dihydro-4H-thiazolo[5,4-c]pyridin-2-yl)-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide
IUPAC NAME: N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
SYSTEMATIC NAME: N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
MOLECULAR FORMULA: C17H19N3O3S
MOLECULAR WEIGHT: 345.41606
SMILES: CN1CCC2=C(C1)SC(=N2)NC(=O)C3=CC4=C(C=C3)OCCCO4
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Product OPENEYE NAME: (Z)-2-(4-methylthiazol-2-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enenitrile
CAS Name: (Z)-2-(4-methyl-2-thiazolyl)-3-(3,4,5-trimethoxyphenyl)-2-propenenitrile
IUPAC NAME: (Z)-2-(4-methyl-1,3-thiazol-2-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enenitrile
SYSTEMATIC NAME: (Z)-2-(4-methyl-1,3-thiazol-2-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enenitrile
MOLECULAR FORMULA: C16H16N2O3S
MOLECULAR WEIGHT: 316.37484
SMILES: CC1=CSC(=N1)/C(=C\C2=CC(=C(C(=C2)OC)OC)OC)/C#N
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Product OPENEYE NAME: (Z)-3-(4-fluorophenyl)-2-(4-methylthiazol-2-yl)prop-2-enenitrile
CAS Name: (Z)-3-(4-fluorophenyl)-2-(4-methyl-2-thiazolyl)-2-propenenitrile
IUPAC NAME: (Z)-3-(4-fluorophenyl)-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile
SYSTEMATIC NAME: (Z)-3-(4-fluorophenyl)-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile
MOLECULAR FORMULA: C13H9FN2S
MOLECULAR WEIGHT: 244.287363
SMILES: CC1=CSC(=N1)/C(=C\C2=CC=C(C=C2)F)/C#N
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Product OPENEYE NAME: (Z)-3-(4-ethoxy-3-methoxy-phenyl)-2-(4-methylthiazol-2-yl)prop-2-enenitrile
CAS Name: (Z)-3-(4-ethoxy-3-methoxyphenyl)-2-(4-methyl-2-thiazolyl)-2-propenenitrile
IUPAC NAME: (Z)-3-(4-ethoxy-3-methoxyphenyl)-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile
SYSTEMATIC NAME: (Z)-3-(4-ethoxy-3-methoxy-phenyl)-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile
MOLECULAR FORMULA: C16H16N2O2S
MOLECULAR WEIGHT: 300.37544
SMILES: CCOC1=C(C=C(C=C1)/C=C(/C#N)\C2=NC(=CS2)C)OC
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Product OPENEYE NAME: (Z)-3-(3-methoxyphenyl)-2-(4-methylthiazol-2-yl)prop-2-enenitrile
CAS Name: (Z)-3-(3-methoxyphenyl)-2-(4-methyl-2-thiazolyl)-2-propenenitrile
IUPAC NAME: (Z)-3-(3-methoxyphenyl)-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile
SYSTEMATIC NAME: (Z)-3-(3-methoxyphenyl)-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile
MOLECULAR FORMULA: C14H12N2OS
MOLECULAR WEIGHT: 256.32288
SMILES: CC1=CSC(=N1)/C(=C\C2=CC(=CC=C2)OC)/C#N
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Product OPENEYE NAME: (Z)-3-(3-ethoxy-4-methoxy-phenyl)-2-(4-methylthiazol-2-yl)prop-2-enenitrile
CAS Name: (Z)-3-(3-ethoxy-4-methoxyphenyl)-2-(4-methyl-2-thiazolyl)-2-propenenitrile
IUPAC NAME: (Z)-3-(3-ethoxy-4-methoxyphenyl)-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile
SYSTEMATIC NAME: (Z)-3-(3-ethoxy-4-methoxy-phenyl)-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile
MOLECULAR FORMULA: C16H16N2O2S
MOLECULAR WEIGHT: 300.37544
SMILES: CCOC1=C(C=CC(=C1)/C=C(/C#N)\C2=NC(=CS2)C)OC
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Product OPENEYE NAME: (Z)-3-(4-allyloxy-3-methoxy-phenyl)-2-(4-methylthiazol-2-yl)prop-2-enenitrile
CAS Name: (Z)-3-(3-methoxy-4-prop-2-enoxyphenyl)-2-(4-methyl-2-thiazolyl)-2-propenenitrile
IUPAC NAME: (Z)-3-(3-methoxy-4-prop-2-enoxyphenyl)-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile
SYSTEMATIC NAME: (Z)-3-(3-methoxy-4-prop-2-enoxy-phenyl)-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile
MOLECULAR FORMULA: C17H16N2O2S
MOLECULAR WEIGHT: 312.38614
SMILES: CC1=CSC(=N1)/C(=C\C2=CC(=C(C=C2)OCC=C)OC)/C#N
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Product OPENEYE NAME: (Z)-3-[4-[2-cyanoethyl(methyl)amino]phenyl]-2-(4-methylthiazol-2-yl)prop-2-enenitrile
CAS Name: (Z)-3-[4-[2-cyanoethyl(methyl)amino]phenyl]-2-(4-methyl-2-thiazolyl)-2-propenenitrile
IUPAC NAME: (Z)-3-[4-[2-cyanoethyl(methyl)amino]phenyl]-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile
SYSTEMATIC NAME: (Z)-3-[4-[2-cyanoethyl(methyl)amino]phenyl]-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile
MOLECULAR FORMULA: C17H16N4S
MOLECULAR WEIGHT: 308.40074
SMILES: CC1=CSC(=N1)/C(=C\C2=CC=C(C=C2)N(C)CCC#N)/C#N
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Product OPENEYE NAME: 1-(3-chlorophenyl)-3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)thiourea
CAS Name: 1-(3-chlorophenyl)-3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)thiourea
IUPAC NAME: 1-(3-chlorophenyl)-3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)thiourea
SYSTEMATIC NAME: 1-(3-chlorophenyl)-3-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)thiourea
MOLECULAR FORMULA: C15H18ClN5S
MOLECULAR WEIGHT: 335.85492
SMILES: C1CCC2=NN=C(N2CC1)CNC(=S)NC3=CC(=CC=C3)Cl
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Product OPENEYE NAME: 2,5-dimethyl-N-(3-morpholinopropyl)thiophene-3-sulfonamide
CAS Name: 2,5-dimethyl-N-[3-(4-morpholinyl)propyl]-3-thiophenesulfonamide
IUPAC NAME: 2,5-dimethyl-N-(3-morpholin-4-ylpropyl)thiophene-3-sulfonamide
SYSTEMATIC NAME: 2,5-dimethyl-N-(3-morpholin-4-ylpropyl)thiophene-3-sulfonamide
MOLECULAR FORMULA: C13H22N2O3S2
MOLECULAR WEIGHT: 318.45538
SMILES: CC1=CC(=C(S1)C)S(=O)(=O)NCCCN2CCOCC2
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Product OPENEYE NAME: 3-[(2,5-dimethyl-3-thienyl)sulfonylamino]benzamide
CAS Name: 3-[(2,5-dimethyl-3-thiophenyl)sulfonylamino]benzamide
IUPAC NAME: 3-[(2,5-dimethylthiophen-3-yl)sulfonylamino]benzamide
SYSTEMATIC NAME: 3-[(2,5-dimethylthiophen-3-yl)sulfonylamino]benzamide
MOLECULAR FORMULA: C13H14N2O3S2
MOLECULAR WEIGHT: 310.39186
SMILES: CC1=CC(=C(S1)C)S(=O)(=O)NC2=CC=CC(=C2)C(=O)N
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Product OPENEYE NAME: 3-[(2,5-dimethyl-3-thienyl)sulfonylamino]-N-ethyl-benzamide
CAS Name: 3-[(2,5-dimethyl-3-thiophenyl)sulfonylamino]-N-ethylbenzamide
IUPAC NAME: 3-[(2,5-dimethylthiophen-3-yl)sulfonylamino]-N-ethylbenzamide
SYSTEMATIC NAME: 3-[(2,5-dimethylthiophen-3-yl)sulfonylamino]-N-ethyl-benzamide
MOLECULAR FORMULA: C15H18N2O3S2
MOLECULAR WEIGHT: 338.44502
SMILES: CCNC(=O)C1=CC(=CC=C1)NS(=O)(=O)C2=C(SC(=C2)C)C
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Product OPENEYE NAME: 1-(3-methoxyphenyl)-N,N-dimethyl-N'-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)ethane-1,2-diamine
CAS Name: 1-(3-methoxyphenyl)-N,N-dimethyl-N'-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)ethane-1,2-diamine
IUPAC NAME: 1-(3-methoxyphenyl)-N,N-dimethyl-N'-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)ethane-1,2-diamine
SYSTEMATIC NAME: 1-(3-methoxyphenyl)-N,N-dimethyl-N'-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)ethane-1,2-diamine
MOLECULAR FORMULA: C17H22N6O
MOLECULAR WEIGHT: 326.39618
SMILES: CC1=NC2=NC=NN2C(=C1)NCC(C3=CC(=CC=C3)OC)N(C)C
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Product OPENEYE NAME: N-[2-(2-furyl)ethyl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
CAS Name: N-[2-(2-furanyl)ethyl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
IUPAC NAME: N-[2-(furan-2-yl)ethyl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
SYSTEMATIC NAME: N-[2-(furan-2-yl)ethyl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
MOLECULAR FORMULA: C12H13N5O
MOLECULAR WEIGHT: 243.26452
SMILES: CC1=NC2=NC=NN2C(=C1)NCCC3=CC=CO3
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Product OPENEYE NAME: 2-[4-(4-pyridylmethyl)piperazin-1-yl]pyridine-3-carbonitrile
CAS Name: 2-[4-(pyridin-4-ylmethyl)-1-piperazinyl]-3-pyridinecarbonitrile
IUPAC NAME: 2-[4-(pyridin-4-ylmethyl)piperazin-1-yl]pyridine-3-carbonitrile
SYSTEMATIC NAME: 2-[4-(pyridin-4-ylmethyl)piperazin-1-yl]pyridine-3-carbonitrile
MOLECULAR FORMULA: C16H17N5
MOLECULAR WEIGHT: 279.33968
SMILES: C1CN(CCN1CC2=CC=NC=C2)C3=C(C=CC=N3)C#N
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