Saturday, April 28, 2012

All Chemical Compounds Information




Product OPENEYE NAME: 2-[(R)-(3-oxo-5-propyl-1,2-dihydropyrazol-4-yl)-phenyl-methyl]propanedinitrile
CAS Name: 2-[(R)-(3-oxo-5-propyl-1,2-dihydropyrazol-4-yl)-phenylmethyl]propanedinitrile
IUPAC NAME: 2-[(R)-(3-oxo-5-propyl-1,2-dihydropyrazol-4-yl)-phenylmethyl]propanedinitrile
SYSTEMATIC NAME: 2-[(R)-(3-oxidanylidene-5-propyl-1,2-dihydropyrazol-4-yl)-phenyl-methyl]propanedinitrile
MOLECULAR FORMULA: C16H16N4O
MOLECULAR WEIGHT: 280.32444
SMILES: CCCC1=C(C(=O)NN1)[C@@H](C2=CC=CC=C2)C(C#N)C#N
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Product OPENEYE NAME: 2-[(S)-(3-oxo-5-propyl-1,2-dihydropyrazol-4-yl)-phenyl-methyl]propanedinitrile
CAS Name: 2-[(S)-(3-oxo-5-propyl-1,2-dihydropyrazol-4-yl)-phenylmethyl]propanedinitrile
IUPAC NAME: 2-[(S)-(3-oxo-5-propyl-1,2-dihydropyrazol-4-yl)-phenylmethyl]propanedinitrile
SYSTEMATIC NAME: 2-[(S)-(3-oxidanylidene-5-propyl-1,2-dihydropyrazol-4-yl)-phenyl-methyl]propanedinitrile
MOLECULAR FORMULA: C16H16N4O
MOLECULAR WEIGHT: 280.32444
SMILES: CCCC1=C(C(=O)NN1)[C@H](C2=CC=CC=C2)C(C#N)C#N
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Product OPENEYE NAME: (2S)-2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-2-phenyl-acetic acid
CAS Name: (2S)-2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)thio]-2-phenylacetic acid
IUPAC NAME: (2S)-2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-2-phenylacetic acid
SYSTEMATIC NAME: (2S)-2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-2-phenyl-ethanoic acid
MOLECULAR FORMULA: C18H16N2O2S
MOLECULAR WEIGHT: 324.39684
SMILES: C1CCC2=C(C1)C=C(C(=N2)S[C@@H](C3=CC=CC=C3)C(=O)O)C#N
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Product OPENEYE NAME: (2R)-2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-2-phenyl-acetic acid
CAS Name: (2R)-2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)thio]-2-phenylacetic acid
IUPAC NAME: (2R)-2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-2-phenylacetic acid
SYSTEMATIC NAME: (2R)-2-[(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-2-phenyl-ethanoic acid
MOLECULAR FORMULA: C18H16N2O2S
MOLECULAR WEIGHT: 324.39684
SMILES: C1CCC2=C(C1)C=C(C(=N2)S[C@H](C3=CC=CC=C3)C(=O)O)C#N
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Product OPENEYE NAME: ethyl 6-amino-5-cyano-3-ethyl-spiro[2H-pyrano[2,3-c]pyrazole-4,4'-piperidine]-1'-carboxylate
CAS Name: 6-amino-5-cyano-3-ethyl-1'-spiro[2H-pyrano[2,3-c]pyrazole-4,4'-piperidine]carboxylic acid ethyl ester
IUPAC NAME: ethyl 6-amino-5-cyano-3-ethylspiro[2H-pyrano[2,3-c]pyrazole-4,4'-piperidine]-1'-carboxylate
SYSTEMATIC NAME: ethyl 6-azanyl-5-cyano-3-ethyl-spiro[2H-pyrano[2,3-c]pyrazole-4,4'-piperidine]-1'-carboxylate
MOLECULAR FORMULA: C16H21N5O3
MOLECULAR WEIGHT: 331.36964
SMILES: CCC1=C2C(=NN1)OC(=C(C23CCN(CC3)C(=O)OCC)C#N)N
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Product OPENEYE NAME: 3-amino-N-isopropyl-6-methyl-4-(2-thienyl)-7,8-dihydro-5H-thieno[2,3-b][1,6]naphthyridine-2-carboxamide
CAS Name: 3-amino-6-methyl-N-propan-2-yl-4-thiophen-2-yl-7,8-dihydro-5H-thieno[2,3-b][1,6]naphthyridine-2-carboxamide
IUPAC NAME: 3-amino-6-methyl-N-propan-2-yl-4-thiophen-2-yl-7,8-dihydro-5H-thieno[2,3-b][1,6]naphthyridine-2-carboxamide
SYSTEMATIC NAME: 3-azanyl-6-methyl-N-propan-2-yl-4-thiophen-2-yl-7,8-dihydro-5H-thieno[2,3-b][1,6]naphthyridine-2-carboxamide
MOLECULAR FORMULA: C19H22N4OS2
MOLECULAR WEIGHT: 386.53418
SMILES: CC(C)NC(=O)C1=C(C2=C(C3=C(CCN(C3)C)N=C2S1)C4=CC=CS4)N
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Product OPENEYE NAME: 4-[[2-[[3-cyano-4-methyl-6-(trifluoromethyl)-2-pyridyl]sulfanyl]acetyl]amino]benzamide
CAS Name: 4-[[2-[[3-cyano-4-methyl-6-(trifluoromethyl)-2-pyridinyl]thio]-1-oxoethyl]amino]benzamide
IUPAC NAME: 4-[[2-[3-cyano-4-methyl-6-(trifluoromethyl)pyridin-2-yl]sulfanylacetyl]amino]benzamide
SYSTEMATIC NAME: 4-[2-[3-cyano-4-methyl-6-(trifluoromethyl)pyridin-2-yl]sulfanylethanoylamino]benzamide
MOLECULAR FORMULA: C17H13F3N4O2S
MOLECULAR WEIGHT: 394.37093
SMILES: CC1=CC(=NC(=C1C#N)SCC(=O)NC2=CC=C(C=C2)C(=O)N)C(F)(F)F
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Product OPENEYE NAME: (8R,8aS)-2-acetyl-6-amino-8-(2-thienyl)-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile
CAS Name: (8R,8aS)-2-acetyl-6-amino-8-thiophen-2-yl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile
IUPAC NAME: (8R,8aS)-2-acetyl-6-amino-8-thiophen-2-yl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile
SYSTEMATIC NAME: (8R,8aS)-6-azanyl-2-ethanoyl-8-thiophen-2-yl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile
MOLECULAR FORMULA: C18H15N5OS
MOLECULAR WEIGHT: 349.4096
SMILES: CC(=O)N1CC=C2[C@@H](C1)[C@H](C(C(=C2C#N)N)(C#N)C#N)C3=CC=CS3
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Product OPENEYE NAME: (8R,8aR)-2-acetyl-6-amino-8-(2-thienyl)-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile
CAS Name: (8R,8aR)-2-acetyl-6-amino-8-thiophen-2-yl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile
IUPAC NAME: (8R,8aR)-2-acetyl-6-amino-8-thiophen-2-yl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile
SYSTEMATIC NAME: (8R,8aR)-6-azanyl-2-ethanoyl-8-thiophen-2-yl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile
MOLECULAR FORMULA: C18H15N5OS
MOLECULAR WEIGHT: 349.4096
SMILES: CC(=O)N1CC=C2[C@H](C1)[C@H](C(C(=C2C#N)N)(C#N)C#N)C3=CC=CS3
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Product OPENEYE NAME: (8S,8aS)-2-acetyl-6-amino-8-(2-thienyl)-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile
CAS Name: (8S,8aS)-2-acetyl-6-amino-8-thiophen-2-yl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile
IUPAC NAME: (8S,8aS)-2-acetyl-6-amino-8-thiophen-2-yl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile
SYSTEMATIC NAME: (8S,8aS)-6-azanyl-2-ethanoyl-8-thiophen-2-yl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile
MOLECULAR FORMULA: C18H15N5OS
MOLECULAR WEIGHT: 349.4096
SMILES: CC(=O)N1CC=C2[C@@H](C1)[C@@H](C(C(=C2C#N)N)(C#N)C#N)C3=CC=CS3
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Product OPENEYE NAME: (8S,8aR)-2-acetyl-6-amino-8-(2-thienyl)-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile
CAS Name: (8S,8aR)-2-acetyl-6-amino-8-thiophen-2-yl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile
IUPAC NAME: (8S,8aR)-2-acetyl-6-amino-8-thiophen-2-yl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile
SYSTEMATIC NAME: (8S,8aR)-6-azanyl-2-ethanoyl-8-thiophen-2-yl-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile
MOLECULAR FORMULA: C18H15N5OS
MOLECULAR WEIGHT: 349.4096
SMILES: CC(=O)N1CC=C2[C@H](C1)[C@@H](C(C(=C2C#N)N)(C#N)C#N)C3=CC=CS3
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