Saturday, December 1, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 2-benzylsulfanyl-N-[2-(2-furylmethylsulfanyl)ethyl]acetamide
CAS Name: N-[2-(2-furanylmethylthio)ethyl]-2-(phenylmethylthio)acetamide
IUPAC NAME: 2-benzylsulfanyl-N-[2-(furan-2-ylmethylsulfanyl)ethyl]acetamide
SYSTEMATIC NAME: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-2-(phenylmethylsulfanyl)ethanamide
MOLECULAR FORMULA: C16H19NO2S2
MOLECULAR WEIGHT: 321.45756
SMILES: C1=CC=C(C=C1)CSCC(=O)NCCSCC2=CC=CO2
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Product OPENEYE NAME: N-[2-(2-furylmethylsulfanyl)ethyl]-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]acetamide
CAS Name: N-[2-(2-furanylmethylthio)ethyl]-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]acetamide
IUPAC NAME: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]acetamide
SYSTEMATIC NAME: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethanamide
MOLECULAR FORMULA: C16H21N3O3S2
MOLECULAR WEIGHT: 367.48624
SMILES: CCCC1=CC(=O)N=C(N1)SCC(=O)NCCSCC2=CC=CO2
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Product OPENEYE NAME: 2-[2-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-5-yl]thiazole
CAS Name: 2-[2-phenyl-7-(trifluoromethyl)-5-pyrazolo[1,5-a]pyrimidinyl]thiazole
IUPAC NAME: 2-[2-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-5-yl]-1,3-thiazole
SYSTEMATIC NAME: 2-[2-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-5-yl]-1,3-thiazole
MOLECULAR FORMULA: C16H9F3N4S
MOLECULAR WEIGHT: 346.32967
SMILES: C1=CC=C(C=C1)C2=NN3C(=CC(=NC3=C2)C4=NC=CS4)C(F)(F)F
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Product OPENEYE NAME: 4-thiazol-2-yl-6-(trifluoromethyl)pyrimidin-2-amine
CAS Name: 4-(2-thiazolyl)-6-(trifluoromethyl)-2-pyrimidinamine
IUPAC NAME: 4-(1,3-thiazol-2-yl)-6-(trifluoromethyl)pyrimidin-2-amine
SYSTEMATIC NAME: 4-(1,3-thiazol-2-yl)-6-(trifluoromethyl)pyrimidin-2-amine
MOLECULAR FORMULA: C8H5F3N4S
MOLECULAR WEIGHT: 246.21231
SMILES: C1=CSC(=N1)C2=CC(=NC(=N2)N)C(F)(F)F
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Product OPENEYE NAME: tert-butyl N-[2-[2-(allylcarbamothioyl)hydrazino]-2-oxo-ethyl]carbamate
CAS Name: N-[2-oxo-2-[[(prop-2-enylamino)-sulfanylidenemethyl]hydrazo]ethyl]carbamic acid tert-butyl ester
IUPAC NAME: tert-butyl N-[2-oxo-2-[2-(prop-2-enylcarbamothioyl)hydrazinyl]ethyl]carbamate
SYSTEMATIC NAME: tert-butyl N-[2-oxidanylidene-2-[2-(prop-2-enylcarbamothioyl)hydrazinyl]ethyl]carbamate
MOLECULAR FORMULA: C11H20N4O3S
MOLECULAR WEIGHT: 288.3665
SMILES: CC(C)(C)OC(=O)NCC(=O)NNC(=S)NCC=C
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Product OPENEYE NAME: tert-butyl N-[2-[2-(benzylcarbamothioyl)hydrazino]-2-oxo-ethyl]carbamate
CAS Name: N-[2-oxo-2-[[[(phenylmethyl)amino]-sulfanylidenemethyl]hydrazo]ethyl]carbamic acid tert-butyl ester
IUPAC NAME: tert-butyl N-[2-[2-(benzylcarbamothioyl)hydrazinyl]-2-oxoethyl]carbamate
SYSTEMATIC NAME: tert-butyl N-[2-oxidanylidene-2-[2-[(phenylmethyl)carbamothioyl]hydrazinyl]ethyl]carbamate
MOLECULAR FORMULA: C15H22N4O3S
MOLECULAR WEIGHT: 338.42518
SMILES: CC(C)(C)OC(=O)NCC(=O)NNC(=S)NCC1=CC=CC=C1
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Product OPENEYE NAME: tert-butyl N-[2-oxo-2-[2-(phenylcarbamothioyl)hydrazino]ethyl]carbamate
CAS Name: N-[2-[[anilino(sulfanylidene)methyl]hydrazo]-2-oxoethyl]carbamic acid tert-butyl ester
IUPAC NAME: tert-butyl N-[2-oxo-2-[2-(phenylcarbamothioyl)hydrazinyl]ethyl]carbamate
SYSTEMATIC NAME: tert-butyl N-[2-oxidanylidene-2-[2-(phenylcarbamothioyl)hydrazinyl]ethyl]carbamate
MOLECULAR FORMULA: C14H20N4O3S
MOLECULAR WEIGHT: 324.3986
SMILES: CC(C)(C)OC(=O)NCC(=O)NNC(=S)NC1=CC=CC=C1
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Product OPENEYE NAME: 2-[2-cyclopropyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-5-yl]thiazole
CAS Name: 2-[2-cyclopropyl-7-(trifluoromethyl)-5-pyrazolo[1,5-a]pyrimidinyl]thiazole
IUPAC NAME: 2-[2-cyclopropyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-5-yl]-1,3-thiazole
SYSTEMATIC NAME: 2-[2-cyclopropyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-5-yl]-1,3-thiazole
MOLECULAR FORMULA: C13H9F3N4S
MOLECULAR WEIGHT: 310.29757
SMILES: C1CC1C2=NN3C(=CC(=NC3=C2)C4=NC=CS4)C(F)(F)F
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Product OPENEYE NAME: 5-(4-chlorophenyl)-2-cyclopropyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
CAS Name: 5-(4-chlorophenyl)-2-cyclopropyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
IUPAC NAME: 5-(4-chlorophenyl)-2-cyclopropyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
SYSTEMATIC NAME: 5-(4-chlorophenyl)-2-cyclopropyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
MOLECULAR FORMULA: C16H11ClF3N3
MOLECULAR WEIGHT: 337.72685
SMILES: C1CC1C2=NN3C(=CC(=NC3=C2)C4=CC=C(C=C4)Cl)C(F)(F)F
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Product OPENEYE NAME: 5-(6-tert-butyl-1,1-dimethyl-indan-4-yl)-2-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
CAS Name: 5-(6-tert-butyl-1,1-dimethyl-2,3-dihydroinden-4-yl)-2-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
IUPAC NAME: 5-(6-tert-butyl-1,1-dimethyl-2,3-dihydroinden-4-yl)-2-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
SYSTEMATIC NAME: 5-(6-tert-butyl-1,1-dimethyl-2,3-dihydroinden-4-yl)-2-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
MOLECULAR FORMULA: C28H28F3N3
MOLECULAR WEIGHT: 463.53723
SMILES: CC1(CCC2=C1C=C(C=C2C3=NC4=CC(=NN4C(=C3)C(F)(F)F)C5=CC=CC=C5)C(C)(C)C)C
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Product OPENEYE NAME: 2-cyclopropyl-5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
CAS Name: 2-cyclopropyl-5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
IUPAC NAME: 2-cyclopropyl-5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
SYSTEMATIC NAME: 2-cyclopropyl-5-(3,4-dimethoxyphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
MOLECULAR FORMULA: C18H16F3N3O2
MOLECULAR WEIGHT: 363.33375
SMILES: COC1=C(C=C(C=C1)C2=NC3=CC(=NN3C(=C2)C(F)(F)F)C4CC4)OC
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Product OPENEYE NAME: 2-(2-furyl)-5-(3-nitrophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
CAS Name: 2-(2-furanyl)-5-(3-nitrophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
IUPAC NAME: 2-(furan-2-yl)-5-(3-nitrophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
SYSTEMATIC NAME: 2-(furan-2-yl)-5-(3-nitrophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
MOLECULAR FORMULA: C17H9F3N4O3
MOLECULAR WEIGHT: 374.27357
SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])C2=NC3=CC(=NN3C(=C2)C(F)(F)F)C4=CC=CO4
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Product OPENEYE NAME: 2-cyclopropyl-5-(3-nitrophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
CAS Name: 2-cyclopropyl-5-(3-nitrophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
IUPAC NAME: 2-cyclopropyl-5-(3-nitrophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
SYSTEMATIC NAME: 2-cyclopropyl-5-(3-nitrophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
MOLECULAR FORMULA: C16H11F3N4O2
MOLECULAR WEIGHT: 348.27935
SMILES: C1CC1C2=NN3C(=CC(=NC3=C2)C4=CC(=CC=C4)[N+](=O)[O-])C(F)(F)F
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Product OPENEYE NAME: 2-tert-butyl-5-(3-nitrophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
CAS Name: 2-tert-butyl-5-(3-nitrophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
IUPAC NAME: 2-tert-butyl-5-(3-nitrophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
SYSTEMATIC NAME: 2-tert-butyl-5-(3-nitrophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
MOLECULAR FORMULA: C17H15F3N4O2
MOLECULAR WEIGHT: 364.32181
SMILES: CC(C)(C)C1=NN2C(=CC(=NC2=C1)C3=CC(=CC=C3)[N+](=O)[O-])C(F)(F)F
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Product OPENEYE NAME: 2-tert-butyl-5-(4-chlorophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
CAS Name: 2-tert-butyl-5-(4-chlorophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
IUPAC NAME: 2-tert-butyl-5-(4-chlorophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
SYSTEMATIC NAME: 2-tert-butyl-5-(4-chlorophenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
MOLECULAR FORMULA: C17H15ClF3N3
MOLECULAR WEIGHT: 353.76931
SMILES: CC(C)(C)C1=NN2C(=CC(=NC2=C1)C3=CC=C(C=C3)Cl)C(F)(F)F
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