CAS RN: 131929-09-4
CAS Name: 5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3,4-dicarboxylic acid diethyl ester
OPENEYE Name: diethyl 5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3,4-dicarboxylate
IUPAC Name: diethyl 5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3,4-dicarboxylate
SYSTEMATIC NAME: diethyl 5-oxidanylidene-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3,4-dicarboxylate
MOLECULAR FORMULA: C21H23NO5
MOLECULAR WEIGHT: 369.41102
SMILES: CCOC(=O)C1C(=CNC2=C1C(=O)CC(C2)C3=CC=CC=C3)C(=O)OCC
Structure:
CAS RN: 137987-38-3
CAS Name: 4-(3,4-dimethoxyphenyl)-2,4,5,10-tetrahydro-1H-pyrrolo[3,4-c][1,5]benzodiazepin-3-one
OPENEYE Name: 4-(3,4-dimethoxyphenyl)-2,4,5,10-tetrahydro-1H-pyrrolo[3,4-c][1,5]benzodiazepin-3-one
IUPAC Name: 4-(3,4-dimethoxyphenyl)-2,4,5,10-tetrahydro-1H-pyrrolo[3,4-c][1,5]benzodiazepin-3-one
SYSTEMATIC NAME: 4-(3,4-dimethoxyphenyl)-2,4,5,10-tetrahydro-1H-pyrrolo[3,4-c][1,5]benzodiazepin-3-one
MOLECULAR FORMULA: C19H19N3O3
MOLECULAR WEIGHT: 337.37246
SMILES: COC1=C(C=C(C=C1)C2C3=C(CNC3=O)NC4=CC=CC=C4N2)OC
Structure:
CAS RN: 295344-96-6
CAS Name: 3-(4-methoxyphenyl)-3-[(4-methylphenyl)sulfonylamino]propanoic acid
OPENEYE Name: 3-(4-methoxyphenyl)-3-(p-tolylsulfonylamino)propanoic acid
IUPAC Name: 3-(4-methoxyphenyl)-3-[(4-methylphenyl)sulfonylamino]propanoic acid
SYSTEMATIC NAME: 3-(4-methoxyphenyl)-3-[(4-methylphenyl)sulfonylamino]propanoic acid
MOLECULAR FORMULA: C17H19NO5S
MOLECULAR WEIGHT: 349.40146
SMILES: CC1=CC=C(C=C1)S(=O)(=O)NC(CC(=O)O)C2=CC=C(C=C2)OC
Structure:
CAS RN: 5218-49-5
CAS Name: thiocyanic acid [2-(2-methylphenyl)sulfonyl-1-phenylethyl] ester
OPENEYE Name: [2-(o-tolylsulfonyl)-1-phenyl-ethyl] thiocyanate
IUPAC Name: [2-(2-methylphenyl)sulfonyl-1-phenylethyl] thiocyanate
SYSTEMATIC NAME: [2-(2-methylphenyl)sulfonyl-1-phenyl-ethyl] thiocyanate
MOLECULAR FORMULA: C16H15NO2S2
MOLECULAR WEIGHT: 317.4258
SMILES: CC1=CC=CC=C1S(=O)(=O)CC(C2=CC=CC=C2)SC#N
Structure:
CAS RN: 101350-88-3
CAS Name: 2-(3-oxo-4H-1,4-benzothiazin-2-yl)-N-phenylacetamide
OPENEYE Name: 2-(3-oxo-4H-1,4-benzothiazin-2-yl)-N-phenyl-acetamide
IUPAC Name: 2-(3-oxo-4H-1,4-benzothiazin-2-yl)-N-phenylacetamide
SYSTEMATIC NAME: 2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)-N-phenyl-ethanamide
MOLECULAR FORMULA: C16H14N2O2S
MOLECULAR WEIGHT: 298.35956
SMILES: C1=CC=C(C=C1)NC(=O)CC2C(=O)NC3=CC=CC=C3S2
Structure:
CAS RN: 5217-31-2
CAS Name: 3-(4-methyl-3-nitrophenyl)-1-adamantanol
OPENEYE Name: 3-(4-methyl-3-nitro-phenyl)adamantan-1-ol
IUPAC Name: 3-(4-methyl-3-nitrophenyl)adamantan-1-ol
SYSTEMATIC NAME: 3-(4-methyl-3-nitro-phenyl)adamantan-1-ol
MOLECULAR FORMULA: C17H21NO3
MOLECULAR WEIGHT: 287.35354
SMILES: CC1=C(C=C(C=C1)C23CC4CC(C2)CC(C4)(C3)O)[N+](=O)[O-]
Structure:
CAS RN: 5216-72-8
CAS Name: N-(4-chlorophenyl)-2,2-diphenyl-1-cyclopropanecarboxamide
OPENEYE Name: N-(4-chlorophenyl)-2,2-diphenyl-cyclopropanecarboxamide
IUPAC Name: N-(4-chlorophenyl)-2,2-diphenylcyclopropane-1-carboxamide
SYSTEMATIC NAME: N-(4-chlorophenyl)-2,2-diphenyl-cyclopropane-1-carboxamide
MOLECULAR FORMULA: C22H18ClNO
MOLECULAR WEIGHT: 347.83742
SMILES: C1C(C1(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)Cl
Structure:
CAS RN: 5216-30-8
CAS Name: 4-tert-butyl-1-[(2,2-dichlorocyclopropyl)methyl]-2-nitrobenzene
OPENEYE Name: 4-tert-butyl-1-[(2,2-dichlorocyclopropyl)methyl]-2-nitro-benzene
IUPAC Name: 4-tert-butyl-1-[(2,2-dichlorocyclopropyl)methyl]-2-nitrobenzene
SYSTEMATIC NAME: 1-[[2,2-bis(chloranyl)cyclopropyl]methyl]-4-tert-butyl-2-nitro-benzene
MOLECULAR FORMULA: C14H17Cl2NO2
MOLECULAR WEIGHT: 302.19628
SMILES: CC(C)(C)C1=CC(=C(C=C1)CC2CC2(Cl)Cl)[N+](=O)[O-]
Structure:
CAS RN: 78816-47-4
CAS Name: N-[11-[3-(4-morpholinyl)-1-oxopropyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamic acid ethyl ester hydrochloride
OPENEYE Name: ethyl N-[11-(3-morpholinopropanoyl)-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate hydrochloride
IUPAC Name: ethyl N-[11-(3-morpholin-4-ylpropanoyl)-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate hydrochloride
SYSTEMATIC NAME: ethyl N-[11-(3-morpholin-4-ylpropanoyl)-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate hydrochloride
MOLECULAR FORMULA: C24H30ClN3O4
MOLECULAR WEIGHT: 459.9657
SMILES: CCOC(=O)NC1=CC2=C(CCC3=CC=CC=C3N2C(=O)CCN4CCOCC4)C=C1.Cl
Structure:
CAS RN: 132362-32-4
CAS Name: N-[10-[2-(dimethylamino)-1-oxoethyl]-2-phenothiazinyl]carbamic acid ethyl ester hydrochloride
OPENEYE Name: ethyl N-[10-[2-(dimethylamino)acetyl]phenothiazin-2-yl]carbamate hydrochloride
IUPAC Name: ethyl N-[10-[2-(dimethylamino)acetyl]phenothiazin-2-yl]carbamate hydrochloride
SYSTEMATIC NAME: ethyl N-[10-[2-(dimethylamino)ethanoyl]phenothiazin-2-yl]carbamate hydrochloride
MOLECULAR FORMULA: C19H22ClN3O3S
MOLECULAR WEIGHT: 407.91428
SMILES: CCOC(=O)NC1=CC2=C(C=C1)SC3=CC=CC=C3N2C(=O)CN(C)C.Cl
Structure:
CAS RN: 24360-97-2
CAS Name: acetic acid; 10-[(1-methyl-3-piperidinyl)methyl]phenothiazine
OPENEYE Name: acetic acid; 10-[(1-methyl-3-piperidyl)methyl]phenothiazine
IUPAC Name: acetic acid; 10-[(1-methylpiperidin-3-yl)methyl]phenothiazine
SYSTEMATIC NAME: ethanoic acid; 10-[(1-methylpiperidin-3-yl)methyl]phenothiazine
MOLECULAR FORMULA: C21H26N2O2S
MOLECULAR WEIGHT: 370.50834
SMILES: CC(=O)O.CN1CCCC(C1)CN2C3=CC=CC=C3SC4=CC=CC=C42
Structure:
CAS RN: 21033-43-2
CAS Name: 2-amino-3-phenothiazinone hydrochloride
OPENEYE Name: 2-aminophenothiazin-3-one hydrochloride
IUPAC Name: 2-aminophenothiazin-3-one hydrochloride
SYSTEMATIC NAME: 2-azanylphenothiazin-3-one hydrochloride
MOLECULAR FORMULA: C12H9ClN2OS
MOLECULAR WEIGHT: 264.73066
SMILES: C1=CC=C2C(=C1)N=C3C=C(C(=O)C=C3S2)N.Cl
Structure:
CAS RN: 5215-82-7
CAS Name: N-[3-chloro-4-(2,3-dichlorophenoxy)phenyl]acetamide
OPENEYE Name: N-[3-chloro-4-(2,3-dichlorophenoxy)phenyl]acetamide
IUPAC Name: N-[3-chloro-4-(2,3-dichlorophenoxy)phenyl]acetamide
SYSTEMATIC NAME: N-[4-[2,3-bis(chloranyl)phenoxy]-3-chloranyl-phenyl]ethanamide
MOLECULAR FORMULA: C14H10Cl3NO2
MOLECULAR WEIGHT: 330.5937
SMILES: CC(=O)NC1=CC(=C(C=C1)OC2=C(C(=CC=C2)Cl)Cl)Cl
Structure:
CAS RN: 67118-34-7
CAS Name: 2-(2-oxo-4-phenyl-1-pyrrolidinyl)acetic acid
OPENEYE Name: 2-(2-oxo-4-phenyl-pyrrolidin-1-yl)acetic acid
IUPAC Name: 2-(2-oxo-4-phenylpyrrolidin-1-yl)acetic acid
SYSTEMATIC NAME: 2-(2-oxidanylidene-4-phenyl-pyrrolidin-1-yl)ethanoic acid
MOLECULAR FORMULA: C12H13NO3
MOLECULAR WEIGHT: 219.23652
SMILES: C1C(CN(C1=O)CC(=O)O)C2=CC=CC=C2
Structure:
CAS RN: 134068-46-5
CAS Name: N-[11-[3-(2-hydroxyethylamino)-1-oxopropyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamic acid ethyl ester hydrochloride
OPENEYE Name: ethyl N-[11-[3-(2-hydroxyethylamino)propanoyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate hydrochloride
IUPAC Name: ethyl N-[11-[3-(2-hydroxyethylamino)propanoyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate hydrochloride
SYSTEMATIC NAME: ethyl N-[11-[3-(2-hydroxyethylamino)propanoyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate hydrochloride
MOLECULAR FORMULA: C22H28ClN3O4
MOLECULAR WEIGHT: 433.92842
SMILES: CCOC(=O)NC1=CC2=C(CCC3=CC=CC=C3N2C(=O)CCNCCO)C=C1.Cl
Structure:
CAS RN: 134068-28-3
CAS Name: N-[11-[2-(methylamino)-1-oxoethyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamic acid methyl ester
OPENEYE Name: methyl N-[11-[2-(methylamino)acetyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate
IUPAC Name: methyl N-[11-[2-(methylamino)acetyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate
SYSTEMATIC NAME: methyl N-[11-[2-(methylamino)ethanoyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate
MOLECULAR FORMULA: C19H21N3O3
MOLECULAR WEIGHT: 339.38834
SMILES: CNCC(=O)N1C2=CC=CC=C2CCC3=C1C=C(C=C3)NC(=O)OC
Structure:
CAS RN: 134068-40-9
CAS Name: N-[11-[2-(2-hydroxyethylamino)-1-oxoethyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamic acid propan-2-yl ester hydrochloride
OPENEYE Name: isopropyl N-[11-[2-(2-hydroxyethylamino)acetyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate hydrochloride
IUPAC Name: propan-2-yl N-[11-[2-(2-hydroxyethylamino)acetyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate hydrochloride
SYSTEMATIC NAME: propan-2-yl N-[11-[2-(2-hydroxyethylamino)ethanoyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate hydrochloride
MOLECULAR FORMULA: C22H28ClN3O4
MOLECULAR WEIGHT: 433.92842
SMILES: CC(C)OC(=O)NC1=CC2=C(CCC3=CC=CC=C3N2C(=O)CNCCO)C=C1.Cl
Structure:
CAS RN: 78816-61-2
CAS Name: N-[11-[3-(4-morpholinyl)-1-oxopropyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamic acid propan-2-yl ester hydrochloride
OPENEYE Name: isopropyl N-[11-(3-morpholinopropanoyl)-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate hydrochloride
IUPAC Name: propan-2-yl N-[11-(3-morpholin-4-ylpropanoyl)-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate hydrochloride
SYSTEMATIC NAME: propan-2-yl N-[11-(3-morpholin-4-ylpropanoyl)-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate hydrochloride
MOLECULAR FORMULA: C25H32ClN3O4
MOLECULAR WEIGHT: 473.99228
SMILES: CC(C)OC(=O)NC1=CC2=C(CCC3=CC=CC=C3N2C(=O)CCN4CCOCC4)C=C1.Cl
Structure:
CAS RN: 78816-48-5
CAS Name: N-[11-[3-(diethylamino)-1-oxopropyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamic acid ethyl ester hydrochloride
OPENEYE Name: ethyl N-[11-[3-(diethylamino)propanoyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate hydrochloride
IUPAC Name: ethyl N-[11-[3-(diethylamino)propanoyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate hydrochloride
SYSTEMATIC NAME: ethyl N-[11-[3-(diethylamino)propanoyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate hydrochloride
MOLECULAR FORMULA: C24H32ClN3O3
MOLECULAR WEIGHT: 445.98218
SMILES: CCN(CC)CCC(=O)N1C2=CC=CC=C2CCC3=C1C=C(C=C3)NC(=O)OCC.Cl
Structure:
CAS RN: 134068-36-3
CAS Name: N-[11-[2-(2-hydroxyethylamino)-1-oxoethyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamic acid ethyl ester hydrochloride
OPENEYE Name: ethyl N-[11-[2-(2-hydroxyethylamino)acetyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate hydrochloride
IUPAC Name: ethyl N-[11-[2-(2-hydroxyethylamino)acetyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate hydrochloride
SYSTEMATIC NAME: ethyl N-[11-[2-(2-hydroxyethylamino)ethanoyl]-5,6-dihydrobenzo[b][1]benzazepin-2-yl]carbamate hydrochloride
MOLECULAR FORMULA: C21H26ClN3O4
MOLECULAR WEIGHT: 419.90184
SMILES: CCOC(=O)NC1=CC2=C(CCC3=CC=CC=C3N2C(=O)CNCCO)C=C1.Cl
Structure:
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