Tuesday, April 3, 2012

http://ChemLookup.com Compounds




CAS RN: 5931-46-4
CAS Name: N-(3-methoxyphenyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide
OPENEYE Name: N-(3-methoxyphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide
IUPAC Name: N-(3-methoxyphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide
SYSTEMATIC NAME: N-(3-methoxyphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide
MOLECULAR FORMULA: C16H15NO4
MOLECULAR WEIGHT: 285.2946
SMILES: COC1=CC=CC(=C1)NC(=O)C2COC3=CC=CC=C3O2
Structure:

CAS RN: 6045-03-0
CAS Name: N'-[2-(4-chlorophenoxy)-1-oxoethyl]-2,3-dihydro-1,4-benzodioxin-3-carbohydrazide
OPENEYE Name: N'-[2-(4-chlorophenoxy)acetyl]-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide
IUPAC Name: N'-[2-(4-chlorophenoxy)acetyl]-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide
SYSTEMATIC NAME: N'-[2-(4-chloranylphenoxy)ethanoyl]-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide
MOLECULAR FORMULA: C17H15ClN2O5
MOLECULAR WEIGHT: 362.7644
SMILES: C1C(OC2=CC=CC=C2O1)C(=O)NNC(=O)COC3=CC=C(C=C3)Cl
Structure:

CAS RN: 6049-07-6
CAS Name: N-(2,5-dimethoxyphenyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide
OPENEYE Name: N-(2,5-dimethoxyphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide
IUPAC Name: N-(2,5-dimethoxyphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide
SYSTEMATIC NAME: N-(2,5-dimethoxyphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide
MOLECULAR FORMULA: C17H17NO5
MOLECULAR WEIGHT: 315.32058
SMILES: COC1=CC(=C(C=C1)OC)NC(=O)C2COC3=CC=CC=C3O2
Structure:

CAS RN: 5657-82-9
CAS Name: 5-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester
OPENEYE Name: diethyl 5-[(3,4-dimethoxybenzoyl)amino]-3-methyl-thiophene-2,4-dicarboxylate
IUPAC Name: diethyl 5-[(3,4-dimethoxybenzoyl)amino]-3-methylthiophene-2,4-dicarboxylate
SYSTEMATIC NAME: diethyl 5-[(3,4-dimethoxyphenyl)carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate
MOLECULAR FORMULA: C20H23NO7S
MOLECULAR WEIGHT: 421.46412
SMILES: CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=CC(=C(C=C2)OC)OC
Structure:

CAS RN: 5635-05-2
CAS Name: 2,3,3-triphenylpropanoic acid (6-oxo-3-benzo[c][1]benzopyranyl) ester
OPENEYE Name: (6-oxobenzo[c]chromen-3-yl) 2,3,3-triphenylpropanoate
IUPAC Name: (6-oxobenzo[c]chromen-3-yl) 2,3,3-triphenylpropanoate
SYSTEMATIC NAME: (6-oxidanylidenebenzo[c]chromen-3-yl) 2,3,3-triphenylpropanoate
MOLECULAR FORMULA: C34H24O4
MOLECULAR WEIGHT: 496.55196
SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)C(C3=CC=CC=C3)C(=O)OC4=CC5=C(C=C4)C6=CC=CC=C6C(=O)O5
Structure:

CAS RN: 5620-45-1
CAS Name: 2-(1H-benzimidazol-2-yl)ethanamine dihydrochloride
OPENEYE Name: 2-(1H-benzimidazol-2-yl)ethanamine dihydrochloride
IUPAC Name: 2-(1H-benzimidazol-2-yl)ethanamine dihydrochloride
SYSTEMATIC NAME: 2-(1H-benzimidazol-2-yl)ethanamine dihydrochloride
MOLECULAR FORMULA: C9H13Cl2N3
MOLECULAR WEIGHT: 234.12562
SMILES: C1=CC=C2C(=C1)NC(=N2)CCN.Cl.Cl
Structure:

CAS RN: 26738-34-1
CAS Name: 5-[(2,4-dichlorophenyl)methylidene]-2-sulfanylidene-4-thiazolidinone
OPENEYE Name: 5-[(2,4-dichlorophenyl)methylene]-2-thioxo-thiazolidin-4-one
IUPAC Name: 5-[(2,4-dichlorophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
SYSTEMATIC NAME: 5-[(2,4-dichlorophenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
MOLECULAR FORMULA: C10H5Cl2NOS2
MOLECULAR WEIGHT: 290.1888
SMILES: C1=CC(=C(C=C1Cl)Cl)C=C2C(=O)NC(=S)S2
Structure:

CAS RN: 6281-61-4
CAS Name: N-[(4-methylanilino)-sulfanylidenemethyl]benzamide
OPENEYE Name: N-(p-tolylcarbamothioyl)benzamide
IUPAC Name: N-[(4-methylphenyl)carbamothioyl]benzamide
SYSTEMATIC NAME: N-[(4-methylphenyl)carbamothioyl]benzamide
MOLECULAR FORMULA: C15H14N2OS
MOLECULAR WEIGHT: 270.34946
SMILES: CC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2
Structure:

CAS RN: 614-78-8
CAS Name: (2-methylphenyl)thiourea
OPENEYE Name: o-tolylthiourea
IUPAC Name: (2-methylphenyl)thiourea
SYSTEMATIC NAME: 1-(2-methylphenyl)thiourea
MOLECULAR FORMULA: C8H10N2S
MOLECULAR WEIGHT: 166.2434
SMILES: CC1=CC=CC=C1NC(=S)N
Structure:

CAS RN: 4144-92-7
CAS Name: 2-[[2-(1,3-dioxo-2-isoindolyl)-4-methyl-1-oxopentyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylic acid ethyl ester
OPENEYE Name: ethyl 2-[[2-(1,3-dioxoisoindolin-2-yl)-4-methyl-pentanoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
IUPAC Name: ethyl 2-[[2-(1,3-dioxoisoindol-2-yl)-4-methylpentanoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
SYSTEMATIC NAME: ethyl 2-[[2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methyl-pentanoyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
MOLECULAR FORMULA: C24H26N2O5S
MOLECULAR WEIGHT: 454.53864
SMILES: CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)C(CC(C)C)N3C(=O)C4=CC=CC=C4C3=O
Structure:

CAS RN: 37530-35-1
CAS Name: 5-[(3-hydroxyphenyl)methylidene]-2-sulfanylidene-4-thiazolidinone
OPENEYE Name: 5-[(3-hydroxyphenyl)methylene]-2-thioxo-thiazolidin-4-one
IUPAC Name: 5-[(3-hydroxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
SYSTEMATIC NAME: 5-[(3-hydroxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
MOLECULAR FORMULA: C10H7NO2S2
MOLECULAR WEIGHT: 237.29808
SMILES: C1=CC(=CC(=C1)O)C=C2C(=O)NC(=S)S2
Structure:

CAS RN: 5362-36-7
CAS Name: N-(2-ethylhexyl)-3,5-dinitrobenzamide
OPENEYE Name: N-(2-ethylhexyl)-3,5-dinitro-benzamide
IUPAC Name: N-(2-ethylhexyl)-3,5-dinitrobenzamide
SYSTEMATIC NAME: N-(2-ethylhexyl)-3,5-dinitro-benzamide
MOLECULAR FORMULA: C15H21N3O5
MOLECULAR WEIGHT: 323.34434
SMILES: CCCCC(CC)CNC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-]
Structure:

CAS RN: 6110-68-5
CAS Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide
OPENEYE Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
IUPAC Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
SYSTEMATIC NAME: N-[2-chloranyl-5-(trifluoromethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
MOLECULAR FORMULA: C16H11ClF3NO3
MOLECULAR WEIGHT: 357.71165
SMILES: C1C(OC2=CC=CC=C2O1)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl
Structure:

CAS RN: 5856-51-9
CAS Name: N-(4-carbamoylphenyl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide
OPENEYE Name: N-(4-carbamoylphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide
IUPAC Name: N-(4-carbamoylphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide
SYSTEMATIC NAME: N-(4-aminocarbonylphenyl)-2,3-dihydro-1,4-benzodioxine-3-carboxamide
MOLECULAR FORMULA: C16H14N2O4
MOLECULAR WEIGHT: 298.29336
SMILES: C1C(OC2=CC=CC=C2O1)C(=O)NC3=CC=C(C=C3)C(=O)N
Structure:

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