Saturday, September 3, 2011

http://ChemLookup.com Compounds




CAS RN: 83060-73-5
CAS Name: 3-amino-5-methyl-2-thiophenecarbonitrile
OPENEYE Name: 3-amino-5-methyl-thiophene-2-carbonitrile
IUPAC Name: 3-amino-5-methylthiophene-2-carbonitrile
SYSTEMATIC NAME: 3-azanyl-5-methyl-thiophene-2-carbonitrile
MOLECULAR FORMULA: C6H6N2S
MOLECULAR WEIGHT: 138.19024
SMILES: CC1=CC(=C(S1)C#N)N
Structure:

CAS RN: 18511-71-2
CAS Name: 4-bromo-2-(4-bromo-2-pyridinyl)pyridine
OPENEYE Name: 4-bromo-2-(4-bromo-2-pyridyl)pyridine
IUPAC Name: 4-bromo-2-(4-bromopyridin-2-yl)pyridine
SYSTEMATIC NAME: 4-bromanyl-2-(4-bromanylpyridin-2-yl)pyridine
MOLECULAR FORMULA: C10H6Br2N2
MOLECULAR WEIGHT: 313.97604
SMILES: C1=CN=C(C=C1Br)C2=NC=CC(=C2)Br
Structure:

CAS RN: 27710-82-3
CAS Name: 3-[bromo(triphenyl)phosphoranyl]-N,N-dimethyl-1-propanamine hydrobromide
OPENEYE Name: 3-[bromo(triphenyl)-$l^{5}-phosphanyl]-N,N-dimethyl-propan-1-amine hydrobromide
IUPAC Name: 3-[bromo(triphenyl)-$l^{5}-phosphanyl]-N,N-dimethylpropan-1-amine hydrobromide
SYSTEMATIC NAME: 3-[bromanyl(triphenyl)-$l^{5}-phosphanyl]-N,N-dimethyl-propan-1-amine hydrobromide
MOLECULAR FORMULA: C23H28Br2NP
MOLECULAR WEIGHT: 509.256881
SMILES: CN(C)CCCP(C1=CC=CC=C1)(C2=CC=CC=C2)(C3=CC=CC=C3)Br.Br
Structure:

CAS RN: 86156-93-6
CAS Name: 3-fluoro-4-nitrobenzenesulfonyl chloride
OPENEYE Name: 3-fluoro-4-nitro-benzenesulfonyl chloride
IUPAC Name: 3-fluoro-4-nitrobenzenesulfonyl chloride
SYSTEMATIC NAME: 3-fluoranyl-4-nitro-benzenesulfonyl chloride
MOLECULAR FORMULA: C6H3ClFNO4S
MOLECULAR WEIGHT: 239.608723
SMILES: C1=CC(=C(C=C1S(=O)(=O)Cl)F)[N+](=O)[O-]
Structure:

CAS RN: 83962-06-5
CAS Name: 4-ethyl-1,3-dihydroimidazol-2-one
OPENEYE Name: 4-ethyl-1,3-dihydroimidazol-2-one
IUPAC Name: 4-ethyl-1,3-dihydroimidazol-2-one
SYSTEMATIC NAME: 4-ethyl-1,3-dihydroimidazol-2-one
MOLECULAR FORMULA: C5H8N2O
MOLECULAR WEIGHT: 112.12982
SMILES: CCC1=CNC(=O)N1
Structure:

CAS RN: 83179-01-5
CAS Name: 7-chloro-6-thieno[3,2-b]pyridinecarboxylic acid ethyl ester
OPENEYE Name: ethyl 7-chlorothieno[3,2-b]pyridine-6-carboxylate
IUPAC Name: ethyl 7-chlorothieno[3,2-b]pyridine-6-carboxylate
SYSTEMATIC NAME: ethyl 7-chloranylthieno[3,2-b]pyridine-6-carboxylate
MOLECULAR FORMULA: C10H8ClNO2S
MOLECULAR WEIGHT: 241.69402
SMILES: CCOC(=O)C1=CN=C2C=CSC2=C1Cl
Structure:

CAS RN: 73220-03-8
CAS Name: 3-bromo-N-[(1-ethyl-2-pyrrolidinyl)methyl]-2,6-dimethoxybenzamide hydrochloride
OPENEYE Name: 3-bromo-N-[(1-ethylpyrrolidin-2-yl)methyl]-2,6-dimethoxy-benzamide hydrochloride
IUPAC Name: 3-bromo-N-[(1-ethylpyrrolidin-2-yl)methyl]-2,6-dimethoxybenzamide hydrochloride
SYSTEMATIC NAME: 3-bromanyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-2,6-dimethoxy-benzamide hydrochloride
MOLECULAR FORMULA: C16H24BrClN2O3
MOLECULAR WEIGHT: 407.73036
SMILES: CCN1CCCC1CNC(=O)C2=C(C=CC(=C2OC)Br)OC.Cl
Structure:

CAS RN: 93904-83-7
CAS Name: 1-methyl-2-oxaspiro[2.5]octane-1-carboxylic acid ethyl ester
OPENEYE Name: ethyl 1-methyl-2-oxaspiro[2.5]octane-1-carboxylate
IUPAC Name: ethyl 1-methyl-2-oxaspiro[2.5]octane-1-carboxylate
SYSTEMATIC NAME: ethyl 1-methyl-2-oxaspiro[2.5]octane-1-carboxylate
MOLECULAR FORMULA: C11H18O3
MOLECULAR WEIGHT: 198.25882
SMILES: CCOC(=O)C1(C2(O1)CCCCC2)C
Structure:

CAS RN: 28910-83-0
CAS Name: (2-amino-5-chlorophenyl)-(2,6-difluorophenyl)methanone
OPENEYE Name: (2-amino-5-chloro-phenyl)-(2,6-difluorophenyl)methanone
IUPAC Name: (2-amino-5-chlorophenyl)-(2,6-difluorophenyl)methanone
SYSTEMATIC NAME: (2-azanyl-5-chloranyl-phenyl)-[2,6-bis(fluoranyl)phenyl]methanone
MOLECULAR FORMULA: C13H8ClF2NO
MOLECULAR WEIGHT: 267.658526
SMILES: C1=CC(=C(C(=C1)F)C(=O)C2=C(C=CC(=C2)Cl)N)F
Structure:

CAS RN: 6654-74-6
CAS Name: 1-hydroxy-5-nitro-2-pyridinimine
OPENEYE Name: 1-hydroxy-5-nitro-pyridin-2-imine
IUPAC Name: 1-hydroxy-5-nitropyridin-2-imine
SYSTEMATIC NAME: 5-nitro-1-oxidanyl-pyridin-2-imine
MOLECULAR FORMULA: C5H5N3O3
MOLECULAR WEIGHT: 155.1115
SMILES: C1=CC(=N)N(C=C1[N+](=O)[O-])O
Structure:

CAS RN: 66933-60-6
CAS Name: 4-(4-morpholinyl)-N-(4-nitrophenyl)-2-pyridinecarboximidoyl chloride hydrochloride
OPENEYE Name: 4-morpholino-N-(4-nitrophenyl)pyridine-2-carboximidoyl chloride hydrochloride
IUPAC Name: 4-morpholin-4-yl-N-(4-nitrophenyl)pyridine-2-carboximidoyl chloride hydrochloride
SYSTEMATIC NAME: 4-morpholin-4-yl-N-(4-nitrophenyl)pyridine-2-carboximidoyl chloride hydrochloride
MOLECULAR FORMULA: C16H16Cl2N4O3
MOLECULAR WEIGHT: 383.22924
SMILES: C1COCCN1C2=CC(=NC=C2)C(=NC3=CC=C(C=C3)[N+](=O)[O-])Cl.Cl
Structure:

CAS RN: 66933-58-2
CAS Name: 4-(4-morpholinyl)-N-phenyl-2-pyridinecarboximidoyl chloride hydrochloride
OPENEYE Name: 4-morpholino-N-phenyl-pyridine-2-carboximidoyl chloride hydrochloride
IUPAC Name: 4-morpholin-4-yl-N-phenylpyridine-2-carboximidoyl chloride hydrochloride
SYSTEMATIC NAME: 4-morpholin-4-yl-N-phenyl-pyridine-2-carboximidoyl chloride hydrochloride
MOLECULAR FORMULA: C16H17Cl2N3O
MOLECULAR WEIGHT: 338.23168
SMILES: C1COCCN1C2=CC(=NC=C2)C(=NC3=CC=CC=C3)Cl.Cl
Structure:

CAS RN: 66933-56-0
CAS Name: N-(4-nitrophenyl)-2-pyridinecarboximidoyl chloride hydrochloride
OPENEYE Name: N-(4-nitrophenyl)pyridine-2-carboximidoyl chloride hydrochloride
IUPAC Name: N-(4-nitrophenyl)pyridine-2-carboximidoyl chloride hydrochloride
SYSTEMATIC NAME: N-(4-nitrophenyl)pyridine-2-carboximidoyl chloride hydrochloride
MOLECULAR FORMULA: C12H9Cl2N3O2
MOLECULAR WEIGHT: 298.12476
SMILES: C1=CC=NC(=C1)C(=NC2=CC=C(C=C2)[N+](=O)[O-])Cl.Cl
Structure:

CAS RN: 66933-55-9
CAS Name: N-phenyl-2-pyridinecarboximidoyl chloride hydrochloride
OPENEYE Name: N-phenylpyridine-2-carboximidoyl chloride hydrochloride
IUPAC Name: N-phenylpyridine-2-carboximidoyl chloride hydrochloride
SYSTEMATIC NAME: N-phenylpyridine-2-carboximidoyl chloride hydrochloride
MOLECULAR FORMULA: C12H10Cl2N2
MOLECULAR WEIGHT: 253.1272
SMILES: C1=CC=C(C=C1)N=C(C2=CC=CC=N2)Cl.Cl
Structure:

CAS RN: 67386-40-7
CAS Name: 2-(2-methoxyphenoxy)ethanimidamide hydrochloride
OPENEYE Name: 2-(2-methoxyphenoxy)acetamidine hydrochloride
IUPAC Name: 2-(2-methoxyphenoxy)ethanimidamide hydrochloride
SYSTEMATIC NAME: 2-(2-methoxyphenoxy)ethanimidamide hydrochloride
MOLECULAR FORMULA: C9H13ClN2O2
MOLECULAR WEIGHT: 216.66472
SMILES: COC1=CC=CC=C1OCC(=N)N.Cl
Structure:

CAS RN: 777801-29-3
CAS Name: 2-(4-bromophenoxy)ethanimidamide hydrochloride
OPENEYE Name: 2-(4-bromophenoxy)acetamidine hydrochloride
IUPAC Name: 2-(4-bromophenoxy)ethanimidamide hydrochloride
SYSTEMATIC NAME: 2-(4-bromanylphenoxy)ethanimidamide hydrochloride
MOLECULAR FORMULA: C8H10BrClN2O
MOLECULAR WEIGHT: 265.5348
SMILES: C1=CC(=CC=C1OCC(=N)N)Br.Cl
Structure:

CAS RN: 66047-75-4
CAS Name: 3-(2-methyl-4-thiazolyl)benzenesulfonyl chloride
OPENEYE Name: 3-(2-methylthiazol-4-yl)benzenesulfonyl chloride
IUPAC Name: 3-(2-methyl-1,3-thiazol-4-yl)benzenesulfonyl chloride
SYSTEMATIC NAME: 3-(2-methyl-1,3-thiazol-4-yl)benzenesulfonyl chloride
MOLECULAR FORMULA: C10H8ClNO2S2
MOLECULAR WEIGHT: 273.75902
SMILES: CC1=NC(=CS1)C2=CC(=CC=C2)S(=O)(=O)Cl
Structure:

CAS RN: 14745-50-7
CAS Name: 3-[1-[(4-methylphenyl)methyl]-4-piperidinyl]-3-phenylpiperidine-2,6-dione
OPENEYE Name: 3-phenyl-3-[1-(p-tolylmethyl)-4-piperidyl]piperidine-2,6-dione
IUPAC Name: 3-[1-[(4-methylphenyl)methyl]piperidin-4-yl]-3-phenylpiperidine-2,6-dione
SYSTEMATIC NAME: 3-[1-[(4-methylphenyl)methyl]piperidin-4-yl]-3-phenyl-piperidine-2,6-dione
MOLECULAR FORMULA: C24H28N2O2
MOLECULAR WEIGHT: 376.49132
SMILES: CC1=CC=C(C=C1)CN2CCC(CC2)C3(CCC(=O)NC3=O)C4=CC=CC=C4
Structure:

CAS RN: 467-82-3
CAS Name: (4R,4aS,6aR,6aS,6bR,8aR,12aR,14bS)-2,2,6a,6b,9,9,12a-heptamethyl-4-(3-methyl-1-oxobut-2-enoxy)-10-oxo-3,4,5,6,6a,7,8,8a,11,12,13,14b-dodecahydro-1H-picene-4a-carboxylic acid
OPENEYE Name: (4R,4aS,6aR,6aS,6bR,8aR,12aR,14bS)-2,2,6a,6b,9,9,12a-heptamethyl-4-(3-methylbut-2-enoyloxy)-10-oxo-3,4,5,6,6a,7,8,8a,11,12,13,14b-dodecahydro-1H-picene-4a-carboxylic acid
IUPAC Name: (4R,4aS,6aR,6aS,6bR,8aR,12aR,14bS)-2,2,6a,6b,9,9,12a-heptamethyl-4-(3-methylbut-2-enoyloxy)-10-oxo-3,4,5,6,6a,7,8,8a,11,12,13,14b-dodecahydro-1H-picene-4a-carboxylic acid
SYSTEMATIC NAME: (4R,4aS,6aR,6aS,6bR,8aR,12aR,14bS)-2,2,6a,6b,9,9,12a-heptamethyl-4-(3-methylbut-2-enoyloxy)-10-oxidanylidene-3,4,5,6,6a,7,8,8a,11,12,13,14b-dodecahydro-1H-picene-4a-carboxylic acid
MOLECULAR FORMULA: C35H52O5
MOLECULAR WEIGHT: 552.78438
SMILES: CC(=CC(=O)O[C@@H]1CC(C[C@@H]2[C@]1(CC[C@@]3(C2=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CCC(=O)C5(C)C)C)C)C)C(=O)O)(C)C)C
Structure:

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