Friday, February 24, 2012

http://ChemLookup.com Compounds




CAS RN: 68322-24-7
CAS Name: 4-thiophen-2-yl-8-azabicyclo[3.2.1]octane-3-carboxylic acid ethyl ester hydrochloride
OPENEYE Name: ethyl 4-(2-thienyl)-8-azabicyclo[3.2.1]octane-3-carboxylate hydrochloride
IUPAC Name: ethyl 4-thiophen-2-yl-8-azabicyclo[3.2.1]octane-3-carboxylate hydrochloride
SYSTEMATIC NAME: ethyl 4-thiophen-2-yl-8-azabicyclo[3.2.1]octane-3-carboxylate hydrochloride
MOLECULAR FORMULA: C14H20ClNO2S
MOLECULAR WEIGHT: 301.8321
SMILES: CCOC(=O)C1CC2CCC(C1C3=CC=CS3)N2.Cl
Structure:

CAS RN: 68322-05-4
CAS Name: 8-methyl-4-thiophen-2-yl-8-azabicyclo[3.2.1]octane-3-carboxylic acid methyl ester hydrochloride
OPENEYE Name: methyl 8-methyl-4-(2-thienyl)-8-azabicyclo[3.2.1]octane-3-carboxylate hydrochloride
IUPAC Name: methyl 8-methyl-4-thiophen-2-yl-8-azabicyclo[3.2.1]octane-3-carboxylate hydrochloride
SYSTEMATIC NAME: methyl 8-methyl-4-thiophen-2-yl-8-azabicyclo[3.2.1]octane-3-carboxylate hydrochloride
MOLECULAR FORMULA: C14H20ClNO2S
MOLECULAR WEIGHT: 301.8321
SMILES: CN1C2CCC1C(C(C2)C(=O)OC)C3=CC=CS3.Cl
Structure:

CAS RN: 68311-70-6
CAS Name: 4-[2-(2-quinolinyl)ethyl]morpholine
OPENEYE Name: 4-[2-(2-quinolyl)ethyl]morpholine
IUPAC Name: 4-(2-quinolin-2-ylethyl)morpholine
SYSTEMATIC NAME: 4-(2-quinolin-2-ylethyl)morpholine
MOLECULAR FORMULA: C15H18N2O
MOLECULAR WEIGHT: 242.31622
SMILES: C1COCCN1CCC2=NC3=CC=CC=C3C=C2
Structure:

CAS RN: 68293-39-0
CAS Name: 2-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)acetic acid
OPENEYE Name: 2-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)acetic acid
IUPAC Name: 2-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)acetic acid
SYSTEMATIC NAME: 2-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)ethanoic acid
MOLECULAR FORMULA: C14H16O2
MOLECULAR WEIGHT: 216.27564
SMILES: C1CC2=CC3=C(CCC3)C(=C2C1)CC(=O)O
Structure:

CAS RN: 68289-27-0
CAS Name: 5,6-bis[4-(dimethylamino)phenyl]-2-methyl-1,2,4-triazine-3-thione
OPENEYE Name: 5,6-bis[4-(dimethylamino)phenyl]-2-methyl-1,2,4-triazine-3-thione
IUPAC Name: 5,6-bis[4-(dimethylamino)phenyl]-2-methyl-1,2,4-triazine-3-thione
SYSTEMATIC NAME: 5,6-bis[4-(dimethylamino)phenyl]-2-methyl-1,2,4-triazine-3-thione
MOLECULAR FORMULA: C20H23N5S
MOLECULAR WEIGHT: 365.49512
SMILES: CN1C(=S)N=C(C(=N1)C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C
Structure:

CAS RN: 68289-26-9
CAS Name: 5,6-bis[4-(dimethylamino)phenyl]-2-(3-methylbut-2-enyl)-1,2,4-triazin-3-one
OPENEYE Name: 5,6-bis[4-(dimethylamino)phenyl]-2-(3-methylbut-2-enyl)-1,2,4-triazin-3-one
IUPAC Name: 5,6-bis[4-(dimethylamino)phenyl]-2-(3-methylbut-2-enyl)-1,2,4-triazin-3-one
SYSTEMATIC NAME: 5,6-bis[4-(dimethylamino)phenyl]-2-(3-methylbut-2-enyl)-1,2,4-triazin-3-one
MOLECULAR FORMULA: C24H29N5O
MOLECULAR WEIGHT: 403.51996
SMILES: CC(=CCN1C(=O)N=C(C(=N1)C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C)C
Structure:

CAS RN: 68289-25-8
CAS Name: 2-[2-(diethylamino)ethyl]-5,6-bis[4-(dimethylamino)phenyl]-1,2,4-triazin-3-one
OPENEYE Name: 2-[2-(diethylamino)ethyl]-5,6-bis[4-(dimethylamino)phenyl]-1,2,4-triazin-3-one
IUPAC Name: 2-[2-(diethylamino)ethyl]-5,6-bis[4-(dimethylamino)phenyl]-1,2,4-triazin-3-one
SYSTEMATIC NAME: 2-[2-(diethylamino)ethyl]-5,6-bis[4-(dimethylamino)phenyl]-1,2,4-triazin-3-one
MOLECULAR FORMULA: C25H34N6O
MOLECULAR WEIGHT: 434.57706
SMILES: CCN(CC)CCN1C(=O)N=C(C(=N1)C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C
Structure:

CAS RN: 68289-24-7
CAS Name: 5,6-bis[4-(dimethylamino)phenyl]-2-[3-(dimethylamino)propyl]-1,2,4-triazin-3-one
OPENEYE Name: 5,6-bis[4-(dimethylamino)phenyl]-2-[3-(dimethylamino)propyl]-1,2,4-triazin-3-one
IUPAC Name: 5,6-bis[4-(dimethylamino)phenyl]-2-[3-(dimethylamino)propyl]-1,2,4-triazin-3-one
SYSTEMATIC NAME: 5,6-bis[4-(dimethylamino)phenyl]-2-[3-(dimethylamino)propyl]-1,2,4-triazin-3-one
MOLECULAR FORMULA: C24H32N6O
MOLECULAR WEIGHT: 420.55048
SMILES: CN(C)CCCN1C(=O)N=C(C(=N1)C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C
Structure:

CAS RN: 68289-23-6
CAS Name: 5,6-bis[4-(dimethylamino)phenyl]-2-prop-2-enyl-1,2,4-triazin-3-one
OPENEYE Name: 2-allyl-5,6-bis[4-(dimethylamino)phenyl]-1,2,4-triazin-3-one
IUPAC Name: 5,6-bis[4-(dimethylamino)phenyl]-2-prop-2-enyl-1,2,4-triazin-3-one
SYSTEMATIC NAME: 5,6-bis[4-(dimethylamino)phenyl]-2-prop-2-enyl-1,2,4-triazin-3-one
MOLECULAR FORMULA: C22H25N5O
MOLECULAR WEIGHT: 375.4668
SMILES: CN(C)C1=CC=C(C=C1)C2=NC(=O)N(N=C2C3=CC=C(C=C3)N(C)C)CC=C
Structure:

CAS RN: 68289-22-5
CAS Name: 5,6-bis[4-(dimethylamino)phenyl]-2-[2-(4-morpholinyl)ethyl]-1,2,4-triazin-3-one
OPENEYE Name: 5,6-bis[4-(dimethylamino)phenyl]-2-(2-morpholinoethyl)-1,2,4-triazin-3-one
IUPAC Name: 5,6-bis[4-(dimethylamino)phenyl]-2-(2-morpholin-4-ylethyl)-1,2,4-triazin-3-one
SYSTEMATIC NAME: 5,6-bis[4-(dimethylamino)phenyl]-2-(2-morpholin-4-ylethyl)-1,2,4-triazin-3-one
MOLECULAR FORMULA: C25H32N6O2
MOLECULAR WEIGHT: 448.56058
SMILES: CN(C)C1=CC=C(C=C1)C2=NC(=O)N(N=C2C3=CC=C(C=C3)N(C)C)CCN4CCOCC4
Structure:

CAS RN: 68289-21-4
CAS Name: 5,6-bis[4-(diethylamino)phenyl]-2-methyl-1,2,4-triazin-3-one
OPENEYE Name: 5,6-bis[4-(diethylamino)phenyl]-2-methyl-1,2,4-triazin-3-one
IUPAC Name: 5,6-bis[4-(diethylamino)phenyl]-2-methyl-1,2,4-triazin-3-one
SYSTEMATIC NAME: 5,6-bis[4-(diethylamino)phenyl]-2-methyl-1,2,4-triazin-3-one
MOLECULAR FORMULA: C24H31N5O
MOLECULAR WEIGHT: 405.53584
SMILES: CCN(CC)C1=CC=C(C=C1)C2=NC(=O)N(N=C2C3=CC=C(C=C3)N(CC)CC)C
Structure:

CAS RN: 68289-18-9
CAS Name: 5-(4-chlorophenyl)-6-[4-(dimethylamino)phenyl]-2-methyl-1,2,4-triazin-3-one
OPENEYE Name: 5-(4-chlorophenyl)-6-[4-(dimethylamino)phenyl]-2-methyl-1,2,4-triazin-3-one
IUPAC Name: 5-(4-chlorophenyl)-6-[4-(dimethylamino)phenyl]-2-methyl-1,2,4-triazin-3-one
SYSTEMATIC NAME: 5-(4-chlorophenyl)-6-[4-(dimethylamino)phenyl]-2-methyl-1,2,4-triazin-3-one
MOLECULAR FORMULA: C18H17ClN4O
MOLECULAR WEIGHT: 340.80678
SMILES: CN1C(=O)N=C(C(=N1)C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)Cl
Structure:

CAS RN: 68289-16-7
CAS Name: 5-(2-chlorophenyl)-6-[4-(dimethylamino)phenyl]-2-methyl-1,2,4-triazin-3-one
OPENEYE Name: 5-(2-chlorophenyl)-6-[4-(dimethylamino)phenyl]-2-methyl-1,2,4-triazin-3-one
IUPAC Name: 5-(2-chlorophenyl)-6-[4-(dimethylamino)phenyl]-2-methyl-1,2,4-triazin-3-one
SYSTEMATIC NAME: 5-(2-chlorophenyl)-6-[4-(dimethylamino)phenyl]-2-methyl-1,2,4-triazin-3-one
MOLECULAR FORMULA: C18H17ClN4O
MOLECULAR WEIGHT: 340.80678
SMILES: CN1C(=O)N=C(C(=N1)C2=CC=C(C=C2)N(C)C)C3=CC=CC=C3Cl
Structure:

CAS RN: 68285-16-5
CAS Name: N-[4-[2-(tert-butylamino)-1-hydroxyethyl]-2-chloro-6-fluorophenyl]carbamic acid ethyl ester hydrochloride
OPENEYE Name: ethyl N-[4-[2-(tert-butylamino)-1-hydroxy-ethyl]-2-chloro-6-fluoro-phenyl]carbamate hydrochloride
IUPAC Name: ethyl N-[4-[2-(tert-butylamino)-1-hydroxyethyl]-2-chloro-6-fluorophenyl]carbamate hydrochloride
SYSTEMATIC NAME: ethyl N-[4-[2-(tert-butylamino)-1-oxidanyl-ethyl]-2-chloranyl-6-fluoranyl-phenyl]carbamate hydrochloride
MOLECULAR FORMULA: C15H23Cl2FN2O3
MOLECULAR WEIGHT: 369.259123
SMILES: CCOC(=O)NC1=C(C=C(C=C1Cl)C(CNC(C)(C)C)O)F.Cl
Structure:

CAS RN: 68274-56-6
CAS Name: 2-(2-ethoxy-3-methylphenyl)-4-oxo-1H-quinazoline-6-carboxylic acid
OPENEYE Name: 2-(2-ethoxy-3-methyl-phenyl)-4-oxo-1H-quinazoline-6-carboxylic acid
IUPAC Name: 2-(2-ethoxy-3-methylphenyl)-4-oxo-1H-quinazoline-6-carboxylic acid
SYSTEMATIC NAME: 2-(2-ethoxy-3-methyl-phenyl)-4-oxidanylidene-1H-quinazoline-6-carboxylic acid
MOLECULAR FORMULA: C18H16N2O4
MOLECULAR WEIGHT: 324.33064
SMILES: CCOC1=C(C=CC=C1C)C2=NC(=O)C3=C(N2)C=CC(=C3)C(=O)O
Structure:

CAS RN: 68274-52-2
CAS Name: 2-(2-ethoxy-5-methoxyphenyl)-4-oxo-1H-quinazoline-6-carboxylic acid
OPENEYE Name: 2-(2-ethoxy-5-methoxy-phenyl)-4-oxo-1H-quinazoline-6-carboxylic acid
IUPAC Name: 2-(2-ethoxy-5-methoxyphenyl)-4-oxo-1H-quinazoline-6-carboxylic acid
SYSTEMATIC NAME: 2-(2-ethoxy-5-methoxy-phenyl)-4-oxidanylidene-1H-quinazoline-6-carboxylic acid
MOLECULAR FORMULA: C18H16N2O5
MOLECULAR WEIGHT: 340.33004
SMILES: CCOC1=C(C=C(C=C1)OC)C2=NC(=O)C3=C(N2)C=CC(=C3)C(=O)O
Structure:

CAS RN: 68274-49-7
CAS Name: 2-(2,3-dimethoxyphenyl)-4-oxo-1H-quinazoline-6-carboxylic acid
OPENEYE Name: 2-(2,3-dimethoxyphenyl)-4-oxo-1H-quinazoline-6-carboxylic acid
IUPAC Name: 2-(2,3-dimethoxyphenyl)-4-oxo-1H-quinazoline-6-carboxylic acid
SYSTEMATIC NAME: 2-(2,3-dimethoxyphenyl)-4-oxidanylidene-1H-quinazoline-6-carboxylic acid
MOLECULAR FORMULA: C17H14N2O5
MOLECULAR WEIGHT: 326.30346
SMILES: COC1=CC=CC(=C1OC)C2=NC(=O)C3=C(N2)C=CC(=C3)C(=O)O
Structure:

CAS RN: 68274-48-6
CAS Name: 2-(2-ethoxy-3-methoxyphenyl)-4-oxo-1H-quinazoline-6-carboxylic acid
OPENEYE Name: 2-(2-ethoxy-3-methoxy-phenyl)-4-oxo-1H-quinazoline-6-carboxylic acid
IUPAC Name: 2-(2-ethoxy-3-methoxyphenyl)-4-oxo-1H-quinazoline-6-carboxylic acid
SYSTEMATIC NAME: 2-(2-ethoxy-3-methoxy-phenyl)-4-oxidanylidene-1H-quinazoline-6-carboxylic acid
MOLECULAR FORMULA: C18H16N2O5
MOLECULAR WEIGHT: 340.33004
SMILES: CCOC1=C(C=CC=C1OC)C2=NC(=O)C3=C(N2)C=CC(=C3)C(=O)O
Structure:

CAS RN: 68256-41-7
CAS Name: 4-chloro-N-[(1-ethyl-2-pyrrolidinyl)methyl]-5-(methanesulfonamido)-2-methoxybenzamide
OPENEYE Name: 4-chloro-N-[(1-ethylpyrrolidin-2-yl)methyl]-5-(methanesulfonamido)-2-methoxy-benzamide
IUPAC Name: 4-chloro-N-[(1-ethylpyrrolidin-2-yl)methyl]-5-(methanesulfonamido)-2-methoxybenzamide
SYSTEMATIC NAME: 4-chloranyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-2-methoxy-5-(methylsulfonylamino)benzamide
MOLECULAR FORMULA: C16H24ClN3O4S
MOLECULAR WEIGHT: 389.89746
SMILES: CCN1CCCC1CNC(=O)C2=CC(=C(C=C2OC)Cl)NS(=O)(=O)C
Structure:

CAS RN: 68256-26-8
CAS Name: N-[(1-ethyl-2-pyrrolidinyl)methyl]-2-methoxy-5-(sulfamoylamino)benzamide
OPENEYE Name: N-[(1-ethylpyrrolidin-2-yl)methyl]-2-methoxy-5-(sulfamoylamino)benzamide
IUPAC Name: N-[(1-ethylpyrrolidin-2-yl)methyl]-2-methoxy-5-(sulfamoylamino)benzamide
SYSTEMATIC NAME: N-[(1-ethylpyrrolidin-2-yl)methyl]-2-methoxy-5-(sulfamoylamino)benzamide
MOLECULAR FORMULA: C15H24N4O4S
MOLECULAR WEIGHT: 356.44046
SMILES: CCN1CCCC1CNC(=O)C2=C(C=CC(=C2)NS(=O)(=O)N)OC
Structure:

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