Thursday, September 27, 2012

http://ChemLookup.com Compounds




CAS RN: 14189-65-2
CAS Name: 3-[(4-chlorophenyl)-phenylmethoxy]-1-propan-2-ylpyrrolidine hydrochloride
OPENEYE Name: 3-[(4-chlorophenyl)-phenyl-methoxy]-1-isopropyl-pyrrolidine hydrochloride
IUPAC Name: 3-[(4-chlorophenyl)-phenylmethoxy]-1-propan-2-ylpyrrolidine hydrochloride
SYSTEMATIC NAME: 3-[(4-chlorophenyl)-phenyl-methoxy]-1-propan-2-yl-pyrrolidine hydrochloride
MOLECULAR FORMULA: C20H25Cl2NO
MOLECULAR WEIGHT: 366.3246
SMILES: CC(C)N1CCC(C1)OC(C2=CC=CC=C2)C3=CC=C(C=C3)Cl.Cl
Structure:

CAS RN: 14188-58-0
CAS Name: 4-[[2-(cyclohexylamino)-1-oxoethyl]amino]-2-hydroxybenzoic acid 2-(diethylamino)ethyl ester dihydrochloride
OPENEYE Name: 2-(diethylamino)ethyl 4-[[2-(cyclohexylamino)acetyl]amino]-2-hydroxy-benzoate dihydrochloride
IUPAC Name: 2-(diethylamino)ethyl 4-[[2-(cyclohexylamino)acetyl]amino]-2-hydroxybenzoate dihydrochloride
SYSTEMATIC NAME: 2-(diethylamino)ethyl 4-[2-(cyclohexylamino)ethanoylamino]-2-oxidanyl-benzoate dihydrochloride
MOLECULAR FORMULA: C21H35Cl2N3O4
MOLECULAR WEIGHT: 464.4263
SMILES: CCN(CC)CCOC(=O)C1=C(C=C(C=C1)NC(=O)CNC2CCCCC2)O.Cl.Cl
Structure:

CAS RN: 14188-02-4
CAS Name: 2-[(phenylthio)methyl]benzoic acid 2-(dimethylamino)ethyl ester hydrochloride
OPENEYE Name: 2-(dimethylamino)ethyl 2-(phenylsulfanylmethyl)benzoate hydrochloride
IUPAC Name: 2-(dimethylamino)ethyl 2-(phenylsulfanylmethyl)benzoate hydrochloride
SYSTEMATIC NAME: 2-(dimethylamino)ethyl 2-(phenylsulfanylmethyl)benzoate hydrochloride
MOLECULAR FORMULA: C18H22ClNO2S
MOLECULAR WEIGHT: 351.89078
SMILES: CN(C)CCOC(=O)C1=CC=CC=C1CSC2=CC=CC=C2.Cl
Structure:

CAS RN: 14186-07-3
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H28ClNO
MOLECULAR WEIGHT: 357.91682
SMILES: CC(CN(C)C)OCC1CC2C3=CC=CC=C3C1C4=CC=CC=C24.Cl
Structure:

CAS RN: 14186-06-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C24H30ClNO
MOLECULAR WEIGHT: 383.9541
SMILES: C1CCN(CC1)CCOCC2CC3C4=CC=CC=C4C2C5=CC=CC=C35.Cl
Structure:

CAS RN: 14185-24-1
CAS Name: 2-methyl-3-(methylamino)-1,1-diphenyl-1-propanol hydrochloride
OPENEYE Name: 2-methyl-3-(methylamino)-1,1-diphenyl-propan-1-ol hydrochloride
IUPAC Name: 2-methyl-3-(methylamino)-1,1-diphenylpropan-1-ol hydrochloride
SYSTEMATIC NAME: 2-methyl-3-(methylamino)-1,1-diphenyl-propan-1-ol hydrochloride
MOLECULAR FORMULA: C17H22ClNO
MOLECULAR WEIGHT: 291.81568
SMILES: CC(CNC)C(C1=CC=CC=C1)(C2=CC=CC=C2)O.Cl
Structure:

CAS RN: 14185-20-7
CAS Name: 2-methyl-1,1-diphenyl-3-(propan-2-ylamino)-1-propanol hydrobromide
OPENEYE Name: 3-(isopropylamino)-2-methyl-1,1-diphenyl-propan-1-ol hydrobromide
IUPAC Name: 2-methyl-1,1-diphenyl-3-(propan-2-ylamino)propan-1-ol hydrobromide
SYSTEMATIC NAME: 2-methyl-1,1-diphenyl-3-(propan-2-ylamino)propan-1-ol hydrobromide
MOLECULAR FORMULA: C19H26BrNO
MOLECULAR WEIGHT: 364.31984
SMILES: CC(C)NCC(C)C(C1=CC=CC=C1)(C2=CC=CC=C2)O.Br
Structure:

CAS RN: 14185-15-0
CAS Name: 3-(ethylamino)-2-methyl-1,1-diphenyl-1-propanol hydrochloride
OPENEYE Name: 3-(ethylamino)-2-methyl-1,1-diphenyl-propan-1-ol hydrochloride
IUPAC Name: 3-(ethylamino)-2-methyl-1,1-diphenylpropan-1-ol hydrochloride
SYSTEMATIC NAME: 3-(ethylamino)-2-methyl-1,1-diphenyl-propan-1-ol hydrochloride
MOLECULAR FORMULA: C18H24ClNO
MOLECULAR WEIGHT: 305.84226
SMILES: CCNCC(C)C(C1=CC=CC=C1)(C2=CC=CC=C2)O.Cl
Structure:

CAS RN: 14185-12-7
CAS Name: 3-amino-2-methyl-1,1-bis(4-methylphenyl)-1-propanol
OPENEYE Name: 3-amino-2-methyl-1,1-bis(p-tolyl)propan-1-ol
IUPAC Name: 3-amino-2-methyl-1,1-bis(4-methylphenyl)propan-1-ol
SYSTEMATIC NAME: 3-azanyl-2-methyl-1,1-bis(4-methylphenyl)propan-1-ol
MOLECULAR FORMULA: C18H23NO
MOLECULAR WEIGHT: 269.38132
SMILES: CC1=CC=C(C=C1)C(C2=CC=C(C=C2)C)(C(C)CN)O
Structure:

CAS RN: 14185-11-6
CAS Name: 3-amino-1,1-bis(3-chlorophenyl)-2-methyl-1-propanol hydrochloride
OPENEYE Name: 3-amino-1,1-bis(3-chlorophenyl)-2-methyl-propan-1-ol hydrochloride
IUPAC Name: 3-amino-1,1-bis(3-chlorophenyl)-2-methylpropan-1-ol hydrochloride
SYSTEMATIC NAME: 3-azanyl-1,1-bis(3-chlorophenyl)-2-methyl-propan-1-ol hydrochloride
MOLECULAR FORMULA: C16H18Cl3NO
MOLECULAR WEIGHT: 346.67922
SMILES: CC(CN)C(C1=CC(=CC=C1)Cl)(C2=CC(=CC=C2)Cl)O.Cl
Structure:

CAS RN: 14182-66-2
CAS Name: 2-(4-tert-butylphenyl)-1-(4-morpholinyl)ethanethione
OPENEYE Name: 2-(4-tert-butylphenyl)-1-morpholino-ethanethione
IUPAC Name: 2-(4-tert-butylphenyl)-1-morpholin-4-ylethanethione
SYSTEMATIC NAME: 2-(4-tert-butylphenyl)-1-morpholin-4-yl-ethanethione
MOLECULAR FORMULA: C16H23NOS
MOLECULAR WEIGHT: 277.42492
SMILES: CC(C)(C)C1=CC=C(C=C1)CC(=S)N2CCOCC2
Structure:

CAS RN: 14179-94-3
CAS Name: 3-chloro-3-methyl-1-pentyne
OPENEYE Name: 3-chloro-3-methyl-pent-1-yne
IUPAC Name: 3-chloro-3-methylpent-1-yne
SYSTEMATIC NAME: 3-chloranyl-3-methyl-pent-1-yne
MOLECULAR FORMULA: C6H9Cl
MOLECULAR WEIGHT: 116.58866
SMILES: CCC(C)(C#C)Cl
Structure:

CAS RN: 14176-78-4
CAS Name: 3-(3-methoxyphenyl)-1-(2-phenylethyl)-3-propylpyrrolidine
OPENEYE Name: 3-(3-methoxyphenyl)-1-(2-phenylethyl)-3-propyl-pyrrolidine
IUPAC Name: 3-(3-methoxyphenyl)-1-(2-phenylethyl)-3-propylpyrrolidine
SYSTEMATIC NAME: 3-(3-methoxyphenyl)-1-(2-phenylethyl)-3-propyl-pyrrolidine
MOLECULAR FORMULA: C22H29NO
MOLECULAR WEIGHT: 323.47176
SMILES: CCCC1(CCN(C1)CCC2=CC=CC=C2)C3=CC(=CC=C3)OC
Structure:

CAS RN: 14170-93-5
CAS Name: 2-amino-N1,N4-bis(1-propyl-7-quinolin-1-iumyl)benzene-1,4-dicarboxamide; 4-methylbenzenesulfonate
OPENEYE Name: 2-amino-N1,N4-bis(1-propylquinolin-1-ium-7-yl)terephthalamide; 4-methylbenzenesulfonate
IUPAC Name: 2-amino-1-N,4-N-bis(1-propylquinolin-1-ium-7-yl)benzene-1,4-dicarboxamide; 4-methylbenzenesulfonate
SYSTEMATIC NAME: 2-azanyl-N1,N4-bis(1-propylquinolin-1-ium-7-yl)benzene-1,4-dicarboxamide; 4-methylbenzenesulfonate
MOLECULAR FORMULA: C46H47N5O8S2
MOLECULAR WEIGHT: 862.02408
SMILES: CCC[N+]1=CC=CC2=C1C=C(C=C2)NC(=O)C3=CC(=C(C=C3)C(=O)NC4=CC5=C(C=CC=[N+]5CCC)C=C4)N.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]
Structure:

CAS RN: 14170-91-3
CAS Name: oxalic acid; propanoic acid [1-(3,3-diphenylprop-2-enyl)-4-phenyl-4-piperidinyl] ester
OPENEYE Name: [1-(3,3-diphenylallyl)-4-phenyl-4-piperidyl] propanoate; oxalic acid
IUPAC Name: [1-(3,3-diphenylprop-2-enyl)-4-phenylpiperidin-4-yl] propanoate; oxalic acid
SYSTEMATIC NAME: [1-(3,3-diphenylprop-2-enyl)-4-phenyl-piperidin-4-yl] propanoate; ethanedioic acid
MOLECULAR FORMULA: C31H33NO6
MOLECULAR WEIGHT: 515.59682
SMILES: CCC(=O)OC1(CCN(CC1)CC=C(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.C(=O)(C(=O)O)O
Structure:

CAS RN: 14170-89-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C32H36ClNO2
MOLECULAR WEIGHT: 502.08674
SMILES: CCC(=O)OC1(CCN(CC1)CCC=C2C3=CC=CC=C3CCC4=CC=CC=C42)C5=CC=CC=C5.Cl
Structure:

CAS RN: 14168-09-3
CAS Name: 1-[6-(1-pyrrolidinyl)hexyl]-2-pyrrolidinone
OPENEYE Name: 1-(6-pyrrolidin-1-ylhexyl)pyrrolidin-2-one
IUPAC Name: 1-(6-pyrrolidin-1-ylhexyl)pyrrolidin-2-one
SYSTEMATIC NAME: 1-(6-pyrrolidin-1-ylhexyl)pyrrolidin-2-one
MOLECULAR FORMULA: C14H26N2O
MOLECULAR WEIGHT: 238.36904
SMILES: C1CCN(C1)CCCCCCN2CCCC2=O
Structure:

CAS RN: 14167-75-0
CAS Name: 1,3,5,5-tetrakis(prop-2-enyl)-1,3-diazinane-2,4,6-trione
OPENEYE Name: 1,3,5,5-tetraallylhexahydropyrimidine-2,4,6-trione
IUPAC Name: 1,3,5,5-tetrakis(prop-2-enyl)-1,3-diazinane-2,4,6-trione
SYSTEMATIC NAME: 1,3,5,5-tetrakis(prop-2-enyl)-1,3-diazinane-2,4,6-trione
MOLECULAR FORMULA: C16H20N2O3
MOLECULAR WEIGHT: 288.3416
SMILES: C=CCC1(C(=O)N(C(=O)N(C1=O)CC=C)CC=C)CC=C
Structure:

CAS RN: 14164-56-8
CAS Name: acetic acid (1-methyl-4-phenyl-3,6-dihydro-2H-pyridin-3-yl) ester
OPENEYE Name: (1-methyl-4-phenyl-3,6-dihydro-2H-pyridin-3-yl) acetate
IUPAC Name: (1-methyl-4-phenyl-3,6-dihydro-2H-pyridin-3-yl) acetate
SYSTEMATIC NAME: (1-methyl-4-phenyl-3,6-dihydro-2H-pyridin-3-yl) ethanoate
MOLECULAR FORMULA: C14H17NO2
MOLECULAR WEIGHT: 231.29028
SMILES: CC(=O)OC1CN(CC=C1C2=CC=CC=C2)C
Structure:

CAS RN: 14164-57-9
CAS Name: acetic acid (1-methyl-4-phenyl-3,6-dihydro-2H-pyridin-3-yl) ester hydrobromide
OPENEYE Name: (1-methyl-4-phenyl-3,6-dihydro-2H-pyridin-3-yl) acetate hydrobromide
IUPAC Name: (1-methyl-4-phenyl-3,6-dihydro-2H-pyridin-3-yl) acetate hydrobromide
SYSTEMATIC NAME: (1-methyl-4-phenyl-3,6-dihydro-2H-pyridin-3-yl) ethanoate hydrobromide
MOLECULAR FORMULA: C14H18BrNO2
MOLECULAR WEIGHT: 312.20222
SMILES: CC(=O)OC1CN(CC=C1C2=CC=CC=C2)C.Br
Structure:

CAS RN: 14153-88-9
CAS Name: N,N'-dicyclohexylcarbamimidothioic acid ethyl ester hydrobromide
OPENEYE Name: 1,3-dicyclohexyl-2-ethyl-isothiourea hydrobromide
IUPAC Name: ethyl N,N'-dicyclohexylcarbamimidothioate hydrobromide
SYSTEMATIC NAME: ethyl N,N'-dicyclohexylcarbamimidothioate hydrobromide
MOLECULAR FORMULA: C15H29BrN2S
MOLECULAR WEIGHT: 349.37316
SMILES: CCSC(=NC1CCCCC1)NC2CCCCC2.Br
Structure:

CAS RN: 14153-87-8
CAS Name: N,N'-dicyclohexylcarbamimidothioic acid methyl ester hydroiodide
OPENEYE Name: 1,3-dicyclohexyl-2-methyl-isothiourea hydroiodide
IUPAC Name: methyl N,N'-dicyclohexylcarbamimidothioate hydroiodide
SYSTEMATIC NAME: methyl N,N'-dicyclohexylcarbamimidothioate hydroiodide
MOLECULAR FORMULA: C14H27IN2S
MOLECULAR WEIGHT: 382.34705
SMILES: CSC(=NC1CCCCC1)NC2CCCCC2.I
Structure:

CAS RN: 14153-86-7
CAS Name: N,N'-dicyclohexylcarbamimidothioic acid (phenylmethyl) ester hydrochloride
OPENEYE Name: 2-benzyl-1,3-dicyclohexyl-isothiourea hydrochloride
IUPAC Name: benzyl N,N'-dicyclohexylcarbamimidothioate hydrochloride
SYSTEMATIC NAME: (phenylmethyl) N,N'-dicyclohexylcarbamimidothioate hydrochloride
MOLECULAR FORMULA: C20H31ClN2S
MOLECULAR WEIGHT: 366.99154
SMILES: C1CCC(CC1)NC(=NC2CCCCC2)SCC3=CC=CC=C3.Cl
Structure:

CAS RN: 14153-85-6
CAS Name: N,N'-bis(phenylmethyl)carbamimidothioic acid ethyl ester hydrobromide
OPENEYE Name: 1,3-dibenzyl-2-ethyl-isothiourea hydrobromide
IUPAC Name: ethyl N,N'-dibenzylcarbamimidothioate hydrobromide
SYSTEMATIC NAME: ethyl N,N'-bis(phenylmethyl)carbamimidothioate hydrobromide
MOLECULAR FORMULA: C17H21BrN2S
MOLECULAR WEIGHT: 365.33104
SMILES: CCSC(=NCC1=CC=CC=C1)NCC2=CC=CC=C2.Br
Structure:

CAS RN: 14153-46-9
CAS Name: 1,3-dimethyl-5-phenyl-5,6-dihydro-2H-1,2,4-triazine
OPENEYE Name: 1,3-dimethyl-5-phenyl-5,6-dihydro-2H-1,2,4-triazine
IUPAC Name: 1,3-dimethyl-5-phenyl-5,6-dihydro-2H-1,2,4-triazine
SYSTEMATIC NAME: 1,3-dimethyl-5-phenyl-5,6-dihydro-2H-1,2,4-triazine
MOLECULAR FORMULA: C11H15N3
MOLECULAR WEIGHT: 189.2569
SMILES: CC1=NC(CN(N1)C)C2=CC=CC=C2
Structure:

CAS RN: 14153-45-8
CAS Name: 1,3,5,5-tetramethyl-2,6-dihydro-1,2,4-triazine
OPENEYE Name: 1,3,5,5-tetramethyl-2,6-dihydro-1,2,4-triazine
IUPAC Name: 1,3,5,5-tetramethyl-2,6-dihydro-1,2,4-triazine
SYSTEMATIC NAME: 1,3,5,5-tetramethyl-2,6-dihydro-1,2,4-triazine
MOLECULAR FORMULA: C7H15N3
MOLECULAR WEIGHT: 141.2141
SMILES: CC1=NC(CN(N1)C)(C)C
Structure:

CAS RN: 14149-36-1
CAS Name: 3-ethyl-3-phenylpyridine-2,6-dione
OPENEYE Name: 3-ethyl-3-phenyl-pyridine-2,6-dione
IUPAC Name: 3-ethyl-3-phenylpyridine-2,6-dione
SYSTEMATIC NAME: 3-ethyl-3-phenyl-pyridine-2,6-dione
MOLECULAR FORMULA: C13H13NO2
MOLECULAR WEIGHT: 215.24782
SMILES: CCC1(C=CC(=O)NC1=O)C2=CC=CC=C2
Structure:

CAS RN: 14149-35-0
CAS Name: 3-methyl-3-phenylpiperidine-2,6-dione
OPENEYE Name: 3-methyl-3-phenyl-piperidine-2,6-dione
IUPAC Name: 3-methyl-3-phenylpiperidine-2,6-dione
SYSTEMATIC NAME: 3-methyl-3-phenyl-piperidine-2,6-dione
MOLECULAR FORMULA: C12H13NO2
MOLECULAR WEIGHT: 203.23712
SMILES: CC1(CCC(=O)NC1=O)C2=CC=CC=C2
Structure:

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