Wednesday, January 25, 2012

http://ChemLookup.com Compounds




CAS RN: 164071-35-6
CAS Name: 3,7-dimethyl-2-[3-(4-phenyl-1-piperazinyl)propyl]-5-(1-piperidinyl)pyrido[3,4-d]pyridazine-1,4-dione
OPENEYE Name: 3,7-dimethyl-2-[3-(4-phenylpiperazin-1-yl)propyl]-5-(1-piperidyl)pyrido[3,4-d]pyridazine-1,4-dione
IUPAC Name: 3,7-dimethyl-2-[3-(4-phenylpiperazin-1-yl)propyl]-5-piperidin-1-ylpyrido[3,4-d]pyridazine-1,4-dione
SYSTEMATIC NAME: 3,7-dimethyl-2-[3-(4-phenylpiperazin-1-yl)propyl]-5-piperidin-1-yl-pyrido[3,4-d]pyridazine-1,4-dione
MOLECULAR FORMULA: C27H36N6O2
MOLECULAR WEIGHT: 476.61374
SMILES: CC1=NC(=C2C(=C1)C(=O)N(N(C2=O)C)CCCN3CCN(CC3)C4=CC=CC=C4)N5CCCCC5
Structure:

CAS RN: 164071-31-2
CAS Name: acetic acid (2,6,7-trimethyl-1,5-dioxo-4-pyrido[3,4-d]pyridazinyl) ester
OPENEYE Name: (2,6,7-trimethyl-1,5-dioxo-pyrido[3,4-d]pyridazin-4-yl) acetate
IUPAC Name: (2,6,7-trimethyl-1,5-dioxopyrido[3,4-d]pyridazin-4-yl) acetate
SYSTEMATIC NAME: [2,6,7-trimethyl-1,5-bis(oxidanylidene)pyrido[3,4-d]pyridazin-4-yl] ethanoate
MOLECULAR FORMULA: C12H13N3O4
MOLECULAR WEIGHT: 263.24932
SMILES: CC1=CC2=C(C(=NN(C2=O)C)OC(=O)C)C(=O)N1C
Structure:

CAS RN: 163629-14-9
CAS Name: 2-(2-phenyl-1-indolyl)-N-(phenylmethyl)acetamide
OPENEYE Name: N-benzyl-2-(2-phenylindol-1-yl)acetamide
IUPAC Name: N-benzyl-2-(2-phenylindol-1-yl)acetamide
SYSTEMATIC NAME: 2-(2-phenylindol-1-yl)-N-(phenylmethyl)ethanamide
MOLECULAR FORMULA: C23H20N2O
MOLECULAR WEIGHT: 340.4177
SMILES: C1=CC=C(C=C1)CNC(=O)CN2C3=CC=CC=C3C=C2C4=CC=CC=C4
Structure:

CAS RN: 163629-13-8
CAS Name: 2-(2-methyl-1-indolyl)-N-(phenylmethyl)acetamide
OPENEYE Name: N-benzyl-2-(2-methylindol-1-yl)acetamide
IUPAC Name: N-benzyl-2-(2-methylindol-1-yl)acetamide
SYSTEMATIC NAME: 2-(2-methylindol-1-yl)-N-(phenylmethyl)ethanamide
MOLECULAR FORMULA: C18H18N2O
MOLECULAR WEIGHT: 278.34832
SMILES: CC1=CC2=CC=CC=C2N1CC(=O)NCC3=CC=CC=C3
Structure:

CAS RN: 163629-12-7
CAS Name: 2-(2-methyl-1-indolyl)-1-(4-morpholinyl)ethanone
OPENEYE Name: 2-(2-methylindol-1-yl)-1-morpholino-ethanone
IUPAC Name: 2-(2-methylindol-1-yl)-1-morpholin-4-ylethanone
SYSTEMATIC NAME: 2-(2-methylindol-1-yl)-1-morpholin-4-yl-ethanone
MOLECULAR FORMULA: C15H18N2O2
MOLECULAR WEIGHT: 258.31562
SMILES: CC1=CC2=CC=CC=C2N1CC(=O)N3CCOCC3
Structure:

CAS RN: 163629-11-6
CAS Name: 2-(2-phenyl-1-indolyl)-1-(1-piperidinyl)ethanone
OPENEYE Name: 2-(2-phenylindol-1-yl)-1-(1-piperidyl)ethanone
IUPAC Name: 2-(2-phenylindol-1-yl)-1-piperidin-1-ylethanone
SYSTEMATIC NAME: 2-(2-phenylindol-1-yl)-1-piperidin-1-yl-ethanone
MOLECULAR FORMULA: C21H22N2O
MOLECULAR WEIGHT: 318.41218
SMILES: C1CCN(CC1)C(=O)CN2C3=CC=CC=C3C=C2C4=CC=CC=C4
Structure:

CAS RN: 163629-10-5
CAS Name: 2-(2-methyl-1-indolyl)-1-(1-piperidinyl)ethanone
OPENEYE Name: 2-(2-methylindol-1-yl)-1-(1-piperidyl)ethanone
IUPAC Name: 2-(2-methylindol-1-yl)-1-piperidin-1-ylethanone
SYSTEMATIC NAME: 2-(2-methylindol-1-yl)-1-piperidin-1-yl-ethanone
MOLECULAR FORMULA: C16H20N2O
MOLECULAR WEIGHT: 256.3428
SMILES: CC1=CC2=CC=CC=C2N1CC(=O)N3CCCCC3
Structure:

CAS RN: 163629-08-1
CAS Name: N-cyclohexyl-2-(2-phenyl-1-indolyl)acetamide
OPENEYE Name: N-cyclohexyl-2-(2-phenylindol-1-yl)acetamide
IUPAC Name: N-cyclohexyl-2-(2-phenylindol-1-yl)acetamide
SYSTEMATIC NAME: N-cyclohexyl-2-(2-phenylindol-1-yl)ethanamide
MOLECULAR FORMULA: C22H24N2O
MOLECULAR WEIGHT: 332.43876
SMILES: C1CCC(CC1)NC(=O)CN2C3=CC=CC=C3C=C2C4=CC=CC=C4
Structure:

CAS RN: 163629-07-0
CAS Name: N-cyclohexyl-2-(2-methyl-1-indolyl)acetamide
OPENEYE Name: N-cyclohexyl-2-(2-methylindol-1-yl)acetamide
IUPAC Name: N-cyclohexyl-2-(2-methylindol-1-yl)acetamide
SYSTEMATIC NAME: N-cyclohexyl-2-(2-methylindol-1-yl)ethanamide
MOLECULAR FORMULA: C17H22N2O
MOLECULAR WEIGHT: 270.36938
SMILES: CC1=CC2=CC=CC=C2N1CC(=O)NC3CCCCC3
Structure:

CAS RN: 163000-63-3
CAS Name: (4S)-4-amino-5-[(4,4-dimethylcyclohexyl)amino]-5-oxopentanoic acid
OPENEYE Name: (4S)-4-amino-5-[(4,4-dimethylcyclohexyl)amino]-5-oxo-pentanoic acid
IUPAC Name: (4S)-4-amino-5-[(4,4-dimethylcyclohexyl)amino]-5-oxopentanoic acid
SYSTEMATIC NAME: (4S)-4-azanyl-5-[(4,4-dimethylcyclohexyl)amino]-5-oxidanylidene-pentanoic acid
MOLECULAR FORMULA: C13H24N2O3
MOLECULAR WEIGHT: 256.34126
SMILES: CC1(CCC(CC1)NC(=O)[C@H](CCC(=O)O)N)C
Structure:

CAS RN: 162937-59-9
CAS Name: 2-[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]-N-(2-benzoyl-4-chlorophenyl)acetamide hydrochloride
OPENEYE Name: 2-[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]-N-(2-benzoyl-4-chloro-phenyl)acetamide hydrochloride
IUPAC Name: 2-[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]-N-(2-benzoyl-4-chlorophenyl)acetamide hydrochloride
SYSTEMATIC NAME: 2-[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]-N-[4-chloranyl-2-(phenylcarbonyl)phenyl]ethanamide hydrochloride
MOLECULAR FORMULA: C24H28Cl2N2O2
MOLECULAR WEIGHT: 447.39732
SMILES: C1CCN2CCC[C@H]([C@H]2C1)CC(=O)NC3=C(C=C(C=C3)Cl)C(=O)C4=CC=CC=C4.Cl
Structure:

CAS RN: 162937-54-4
CAS Name: 2-[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]-N-(3-benzoylphenyl)acetamide
OPENEYE Name: 2-[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]-N-(3-benzoylphenyl)acetamide
IUPAC Name: 2-[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]-N-(3-benzoylphenyl)acetamide
SYSTEMATIC NAME: 2-[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]-N-[3-(phenylcarbonyl)phenyl]ethanamide
MOLECULAR FORMULA: C24H28N2O2
MOLECULAR WEIGHT: 376.49132
SMILES: C1CCN2CCC[C@H]([C@H]2C1)CC(=O)NC3=CC=CC(=C3)C(=O)C4=CC=CC=C4
Structure:

CAS RN: 162937-49-7
CAS Name: 2-[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]-N-(2,6-dichlorophenyl)acetamide
OPENEYE Name: 2-[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]-N-(2,6-dichlorophenyl)acetamide
IUPAC Name: 2-[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]-N-(2,6-dichlorophenyl)acetamide
SYSTEMATIC NAME: 2-[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]-N-[2,6-bis(chloranyl)phenyl]ethanamide
MOLECULAR FORMULA: C17H22Cl2N2O
MOLECULAR WEIGHT: 341.27538
SMILES: C1CCN2CCC[C@H]([C@H]2C1)CC(=O)NC3=C(C=CC=C3Cl)Cl
Structure:

CAS RN: 162937-47-5
CAS Name: 2-[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]-N-(2,6-dimethylphenyl)acetamide
OPENEYE Name: 2-[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]-N-(2,6-dimethylphenyl)acetamide
IUPAC Name: 2-[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]-N-(2,6-dimethylphenyl)acetamide
SYSTEMATIC NAME: 2-[(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]-N-(2,6-dimethylphenyl)ethanamide
MOLECULAR FORMULA: C19H28N2O
MOLECULAR WEIGHT: 300.43842
SMILES: CC1=C(C(=CC=C1)C)NC(=O)C[C@@H]2CCCN3[C@@H]2CCCC3
Structure:

CAS RN: 162857-75-2
CAS Name: 3-(2-aziridinyl)-3,7,8,10,12b-pentahydroxy-9,12-dimethoxy-2,4,4a,5-tetrahydrobenzo[a]anthracene-1,6-dione
OPENEYE Name: 3-(aziridin-2-yl)-3,7,8,10,12b-pentahydroxy-9,12-dimethoxy-2,4,4a,5-tetrahydrobenzo[a]anthracene-1,6-dione
IUPAC Name: 3-(aziridin-2-yl)-3,7,8,10,12b-pentahydroxy-9,12-dimethoxy-2,4,4a,5-tetrahydrobenzo[a]anthracene-1,6-dione
SYSTEMATIC NAME: 3-(aziridin-2-yl)-9,12-dimethoxy-3,7,8,10,12b-pentakis(oxidanyl)-2,4,4a,5-tetrahydrobenzo[a]anthracene-1,6-dione
MOLECULAR FORMULA: C22H23NO9
MOLECULAR WEIGHT: 445.41932
SMILES: COC1=C2C(=C(C3=C(C(=C(C=C31)O)OC)O)O)C(=O)CC4C2(C(=O)CC(C4)(C5CN5)O)O
Structure:

CAS RN: 162828-18-4
CAS Name: 5-cyano-2,6-dimethyl-4-(2-nitrophenyl)-3-pyridinecarboxylic acid methyl ester
OPENEYE Name: methyl 5-cyano-2,6-dimethyl-4-(2-nitrophenyl)pyridine-3-carboxylate
IUPAC Name: methyl 5-cyano-2,6-dimethyl-4-(2-nitrophenyl)pyridine-3-carboxylate
SYSTEMATIC NAME: methyl 5-cyano-2,6-dimethyl-4-(2-nitrophenyl)pyridine-3-carboxylate
MOLECULAR FORMULA: C16H13N3O4
MOLECULAR WEIGHT: 311.29212
SMILES: CC1=C(C(=C(C(=N1)C)C#N)C2=CC=CC=C2[N+](=O)[O-])C(=O)OC
Structure:

CAS RN: 162255-92-7
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H18N4O2S
MOLECULAR WEIGHT: 354.42612
SMILES: CC1=CC(=NC2=C1C3=NN(C(=C3N(S2(=O)=O)C)C4=CC=CC=C4)C)C
Structure:

CAS RN: 162255-91-6
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C13H16N4O2S
MOLECULAR WEIGHT: 292.35674
SMILES: CC1=CC(=NC2=C1C3=NN(C(=C3N(S2(=O)=O)C)C)C)C
Structure:

CAS RN: 162254-26-4
CAS Name: 1-[6-[4-(4-fluorophenyl)-1-piperazinyl]hexyl]-2-oxazolo[5,4-b]pyridinone
OPENEYE Name: 1-[6-[4-(4-fluorophenyl)piperazin-1-yl]hexyl]oxazolo[5,4-b]pyridin-2-one
IUPAC Name: 1-[6-[4-(4-fluorophenyl)piperazin-1-yl]hexyl]-[1,3]oxazolo[5,4-b]pyridin-2-one
SYSTEMATIC NAME: 1-[6-[4-(4-fluorophenyl)piperazin-1-yl]hexyl]-[1,3]oxazolo[5,4-b]pyridin-2-one
MOLECULAR FORMULA: C22H27FN4O2
MOLECULAR WEIGHT: 398.473783
SMILES: C1CN(CCN1CCCCCCN2C3=C(N=CC=C3)OC2=O)C4=CC=C(C=C4)F
Structure:

CAS RN: 162254-25-3
CAS Name: 1-[5-[4-(4-fluorophenyl)-1-piperazinyl]pentyl]-2-oxazolo[5,4-b]pyridinone
OPENEYE Name: 1-[5-[4-(4-fluorophenyl)piperazin-1-yl]pentyl]oxazolo[5,4-b]pyridin-2-one
IUPAC Name: 1-[5-[4-(4-fluorophenyl)piperazin-1-yl]pentyl]-[1,3]oxazolo[5,4-b]pyridin-2-one
SYSTEMATIC NAME: 1-[5-[4-(4-fluorophenyl)piperazin-1-yl]pentyl]-[1,3]oxazolo[5,4-b]pyridin-2-one
MOLECULAR FORMULA: C21H25FN4O2
MOLECULAR WEIGHT: 384.447203
SMILES: C1CN(CCN1CCCCCN2C3=C(N=CC=C3)OC2=O)C4=CC=C(C=C4)F
Structure:

CAS RN: 162254-23-1
CAS Name: 1-[4-[4-(4-fluorophenyl)-1-piperazinyl]butyl]-2-oxazolo[5,4-b]pyridinone
OPENEYE Name: 1-[4-[4-(4-fluorophenyl)piperazin-1-yl]butyl]oxazolo[5,4-b]pyridin-2-one
IUPAC Name: 1-[4-[4-(4-fluorophenyl)piperazin-1-yl]butyl]-[1,3]oxazolo[5,4-b]pyridin-2-one
SYSTEMATIC NAME: 1-[4-[4-(4-fluorophenyl)piperazin-1-yl]butyl]-[1,3]oxazolo[5,4-b]pyridin-2-one
MOLECULAR FORMULA: C20H23FN4O2
MOLECULAR WEIGHT: 370.420623
SMILES: C1CN(CCN1CCCCN2C3=C(N=CC=C3)OC2=O)C4=CC=C(C=C4)F
Structure:

CAS RN: 162254-22-0
CAS Name: 1-[3-[4-(4-fluorophenyl)-1-piperazinyl]-2-methylpropyl]-2-oxazolo[5,4-b]pyridinone
OPENEYE Name: 1-[3-[4-(4-fluorophenyl)piperazin-1-yl]-2-methyl-propyl]oxazolo[5,4-b]pyridin-2-one
IUPAC Name: 1-[3-[4-(4-fluorophenyl)piperazin-1-yl]-2-methylpropyl]-[1,3]oxazolo[5,4-b]pyridin-2-one
SYSTEMATIC NAME: 1-[3-[4-(4-fluorophenyl)piperazin-1-yl]-2-methyl-propyl]-[1,3]oxazolo[5,4-b]pyridin-2-one
MOLECULAR FORMULA: C20H23FN4O2
MOLECULAR WEIGHT: 370.420623
SMILES: CC(CN1CCN(CC1)C2=CC=C(C=C2)F)CN3C4=C(N=CC=C4)OC3=O
Structure:

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