Saturday, January 26, 2013

All Chemical Compounds Information




Product OPENEYE NAME: methyl 1-[(E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoyl]piperidine-4-carboxylate
CAS Name: 1-[(E)-1-oxo-3-[3-(trifluoromethyl)phenyl]prop-2-enyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[(E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[(E)-3-[3-(trifluoromethyl)phenyl]prop-2-enoyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C17H18F3NO3
MOLECULAR WEIGHT: 341.32493
SMILES: COC(=O)C1CCN(CC1)C(=O)/C=C/C2=CC(=CC=C2)C(F)(F)F
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Product OPENEYE NAME: methyl 1-[2-[3-(trifluoromethyl)phenyl]acetyl]piperidine-4-carboxylate
CAS Name: 1-[1-oxo-2-[3-(trifluoromethyl)phenyl]ethyl]-4-piperidinecarboxylic acid methyl ester
IUPAC NAME: methyl 1-[2-[3-(trifluoromethyl)phenyl]acetyl]piperidine-4-carboxylate
SYSTEMATIC NAME: methyl 1-[2-[3-(trifluoromethyl)phenyl]ethanoyl]piperidine-4-carboxylate
MOLECULAR FORMULA: C16H18F3NO3
MOLECULAR WEIGHT: 329.31423
SMILES: COC(=O)C1CCN(CC1)C(=O)CC2=CC(=CC=C2)C(F)(F)F
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Product OPENEYE NAME: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-(2,2,2-trifluoroethyl)acetamide
CAS Name: 2-(1,3-benzothiazol-2-ylmethylthio)-N-(2,2,2-trifluoroethyl)acetamide
IUPAC NAME: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-(2,2,2-trifluoroethyl)acetamide
SYSTEMATIC NAME: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[2,2,2-tris(fluoranyl)ethyl]ethanamide
MOLECULAR FORMULA: C12H11F3N2OS2
MOLECULAR WEIGHT: 320.35375
SMILES: C1=CC=C2C(=C1)N=C(S2)CSCC(=O)NCC(F)(F)F
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Product OPENEYE NAME: N-(3-chloro-4-cyano-phenyl)pyridine-4-carboxamide
CAS Name: N-(3-chloro-4-cyanophenyl)-4-pyridinecarboxamide
IUPAC NAME: N-(3-chloro-4-cyanophenyl)pyridine-4-carboxamide
SYSTEMATIC NAME: N-(3-chloranyl-4-cyano-phenyl)pyridine-4-carboxamide
MOLECULAR FORMULA: C13H8ClN3O
MOLECULAR WEIGHT: 257.67512
SMILES: C1=CC(=C(C=C1NC(=O)C2=CC=NC=C2)Cl)C#N
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Product OPENEYE NAME: dimethyl 3-methyl-5-(pyridine-2-carbonylamino)thiophene-2,4-dicarboxylate
CAS Name: 3-methyl-5-[[oxo(2-pyridinyl)methyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester
IUPAC NAME: dimethyl 3-methyl-5-(pyridine-2-carbonylamino)thiophene-2,4-dicarboxylate
SYSTEMATIC NAME: dimethyl 3-methyl-5-(pyridin-2-ylcarbonylamino)thiophene-2,4-dicarboxylate
MOLECULAR FORMULA: C15H14N2O5S
MOLECULAR WEIGHT: 334.34706
SMILES: CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC=CC=N2)C(=O)OC
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Product OPENEYE NAME: 1-[4-(3,4-difluorophenyl)sulfonylpiperazin-1-yl]propan-1-one
CAS Name: 1-[4-(3,4-difluorophenyl)sulfonyl-1-piperazinyl]-1-propanone
IUPAC NAME: 1-[4-(3,4-difluorophenyl)sulfonylpiperazin-1-yl]propan-1-one
SYSTEMATIC NAME: 1-[4-[3,4-bis(fluoranyl)phenyl]sulfonylpiperazin-1-yl]propan-1-one
MOLECULAR FORMULA: C13H16F2N2O3S
MOLECULAR WEIGHT: 318.339546
SMILES: CCC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)F)F
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Product OPENEYE NAME: N'-[3-(2-furyl)propanoyl]-3-methyl-4-oxo-phthalazine-1-carbohydrazide
CAS Name: N'-[3-(2-furanyl)-1-oxopropyl]-3-methyl-4-oxo-1-phthalazinecarbohydrazide
IUPAC NAME: N'-[3-(furan-2-yl)propanoyl]-3-methyl-4-oxophthalazine-1-carbohydrazide
SYSTEMATIC NAME: N'-[3-(furan-2-yl)propanoyl]-3-methyl-4-oxidanylidene-phthalazine-1-carbohydrazide
MOLECULAR FORMULA: C17H16N4O4
MOLECULAR WEIGHT: 340.33334
SMILES: CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CCC3=CC=CO3
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Product OPENEYE NAME: N-(5-methyl-1,3,4-thiadiazol-2-yl)-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide
CAS Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide
IUPAC NAME: N-(5-methyl-1,3,4-thiadiazol-2-yl)-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide
SYSTEMATIC NAME: N-(5-methyl-1,3,4-thiadiazol-2-yl)-5,6-dihydro-4H-cyclopenta[b]thiophene-2-carboxamide
MOLECULAR FORMULA: C11H11N3OS2
MOLECULAR WEIGHT: 265.35454
SMILES: CC1=NN=C(S1)NC(=O)C2=CC3=C(S2)CCC3
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Product OPENEYE NAME: N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxo-4-phenyl-butanamide
CAS Name: N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxo-4-phenylbutanamide
IUPAC NAME: N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxo-4-phenylbutanamide
SYSTEMATIC NAME: N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-oxidanylidene-4-phenyl-butanamide
MOLECULAR FORMULA: C13H13N3O2S
MOLECULAR WEIGHT: 275.32622
SMILES: CC1=NN=C(S1)NC(=O)CCC(=O)C2=CC=CC=C2
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