Friday, March 30, 2012

http://ChemLookup.com Compounds




CAS RN: 6239-41-4
CAS Name: 4-[3-(4-methoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]benzaldehyde
OPENEYE Name: 4-[3-(4-methoxyphenyl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]benzaldehyde
IUPAC Name: 4-[3-(4-methoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]benzaldehyde
SYSTEMATIC NAME: 4-[3-(4-methoxyphenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]benzaldehyde
MOLECULAR FORMULA: C21H18N2O2S
MOLECULAR WEIGHT: 362.44482
SMILES: COC1=CC=C(C=C1)C2CC(=NN2C3=CC=C(C=C3)C=O)C4=CC=CS4
Structure:

CAS RN: 6239-38-9
CAS Name: 4-methyl-N-[(Z)-3-[2-(4-morpholinyl)ethylamino]-3-oxo-1-(3-phenoxyphenyl)prop-1-en-2-yl]benzamide
OPENEYE Name: 4-methyl-N-[(Z)-1-(2-morpholinoethylcarbamoyl)-2-(3-phenoxyphenyl)vinyl]benzamide
IUPAC Name: 4-methyl-N-[(Z)-3-(2-morpholin-4-ylethylamino)-3-oxo-1-(3-phenoxyphenyl)prop-1-en-2-yl]benzamide
SYSTEMATIC NAME: 4-methyl-N-[(Z)-3-(2-morpholin-4-ylethylamino)-3-oxidanylidene-1-(3-phenoxyphenyl)prop-1-en-2-yl]benzamide
MOLECULAR FORMULA: C29H31N3O4
MOLECULAR WEIGHT: 485.57414
SMILES: CC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC(=CC=C2)OC3=CC=CC=C3)/C(=O)NCCN4CCOCC4
Structure:

CAS RN: 6239-34-5
CAS Name: 4-methyl-N-[(Z)-3-[3-(4-morpholinyl)propylamino]-3-oxo-1-(4-propan-2-ylphenyl)prop-1-en-2-yl]benzamide
OPENEYE Name: N-[(Z)-2-(4-isopropylphenyl)-1-(3-morpholinopropylcarbamoyl)vinyl]-4-methyl-benzamide
IUPAC Name: 4-methyl-N-[(Z)-3-(3-morpholin-4-ylpropylamino)-3-oxo-1-(4-propan-2-ylphenyl)prop-1-en-2-yl]benzamide
SYSTEMATIC NAME: 4-methyl-N-[(Z)-3-(3-morpholin-4-ylpropylamino)-3-oxidanylidene-1-(4-propan-2-ylphenyl)prop-1-en-2-yl]benzamide
MOLECULAR FORMULA: C27H35N3O3
MOLECULAR WEIGHT: 449.5851
SMILES: CC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC=C(C=C2)C(C)C)/C(=O)NCCCN3CCOCC3
Structure:

CAS RN: 4357-50-0
CAS Name: 9-(3,4-dimethoxyphenyl)-6-(4-methyl-3-nitrophenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
OPENEYE Name: 9-(3,4-dimethoxyphenyl)-6-(4-methyl-3-nitro-phenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
IUPAC Name: 9-(3,4-dimethoxyphenyl)-6-(4-methyl-3-nitrophenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
SYSTEMATIC NAME: 9-(3,4-dimethoxyphenyl)-6-(4-methyl-3-nitro-phenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
MOLECULAR FORMULA: C28H27N3O5
MOLECULAR WEIGHT: 485.53108
SMILES: CC1=C(C=C(C=C1)C2C3=C(CC(CC3=O)C4=CC(=C(C=C4)OC)OC)NC5=CC=CC=C5N2)[N+](=O)[O-]
Structure:

CAS RN: 6239-01-6
CAS Name: 4-methyl-N-[(Z)-3-oxo-3-(pyridin-4-ylmethylamino)-1-thiophen-2-ylprop-1-en-2-yl]benzamide
OPENEYE Name: 4-methyl-N-[(Z)-1-(4-pyridylmethylcarbamoyl)-2-(2-thienyl)vinyl]benzamide
IUPAC Name: 4-methyl-N-[(Z)-3-oxo-3-(pyridin-4-ylmethylamino)-1-thiophen-2-ylprop-1-en-2-yl]benzamide
SYSTEMATIC NAME: 4-methyl-N-[(Z)-3-oxidanylidene-3-(pyridin-4-ylmethylamino)-1-thiophen-2-yl-prop-1-en-2-yl]benzamide
MOLECULAR FORMULA: C21H19N3O2S
MOLECULAR WEIGHT: 377.45946
SMILES: CC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC=CS2)/C(=O)NCC3=CC=NC=C3
Structure:

CAS RN: 6238-97-7
CAS Name: 2-[[3-(1H-benzimidazol-2-yl)-2-oxo-1-benzopyran-7-yl]oxy]acetic acid ethyl ester
OPENEYE Name: ethyl 2-[3-(1H-benzimidazol-2-yl)-2-oxo-chromen-7-yl]oxyacetate
IUPAC Name: ethyl 2-[3-(1H-benzimidazol-2-yl)-2-oxochromen-7-yl]oxyacetate
SYSTEMATIC NAME: ethyl 2-[3-(1H-benzimidazol-2-yl)-2-oxidanylidene-chromen-7-yl]oxyethanoate
MOLECULAR FORMULA: C20H16N2O5
MOLECULAR WEIGHT: 364.35144
SMILES: CCOC(=O)COC1=CC2=C(C=C1)C=C(C(=O)O2)C3=NC4=CC=CC=C4N3
Structure:

CAS RN: 6238-95-5
CAS Name: 6-methyl-4-(4-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylic acid (phenylmethyl) ester
OPENEYE Name: benzyl 6-methyl-4-(4-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylate
IUPAC Name: benzyl 6-methyl-4-(4-nitrophenyl)-2-oxo-3,4-dihydro-1H-pyridine-5-carboxylate
SYSTEMATIC NAME: (phenylmethyl) 6-methyl-4-(4-nitrophenyl)-2-oxidanylidene-3,4-dihydro-1H-pyridine-5-carboxylate
MOLECULAR FORMULA: C20H18N2O5
MOLECULAR WEIGHT: 366.36732
SMILES: CC1=C(C(CC(=O)N1)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)OCC3=CC=CC=C3
Structure:

CAS RN: 6238-92-2
CAS Name: 2-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxobutyl]benzo[de]isoquinoline-1,3-dione
OPENEYE Name: 2-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxo-butyl]benzo[de]isoquinoline-1,3-dione
IUPAC Name: 2-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxobutyl]benzo[de]isoquinoline-1,3-dione
SYSTEMATIC NAME: 2-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-4-oxidanylidene-butyl]benzo[de]isoquinoline-1,3-dione
MOLECULAR FORMULA: C25H22N2O3
MOLECULAR WEIGHT: 398.45378
SMILES: C1CN(CC2=CC=CC=C21)C(=O)CCCN3C(=O)C4=CC=CC5=C4C(=CC=C5)C3=O
Structure:

CAS RN: 6238-84-2
CAS Name: 2-[2-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]ethyl]benzo[de]isoquinoline-1,3-dione
OPENEYE Name: 2-[2-[4-(furan-2-carbonyl)piperazin-1-yl]ethyl]benzo[de]isoquinoline-1,3-dione
IUPAC Name: 2-[2-[4-(furan-2-carbonyl)piperazin-1-yl]ethyl]benzo[de]isoquinoline-1,3-dione
SYSTEMATIC NAME: 2-[2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]ethyl]benzo[de]isoquinoline-1,3-dione
MOLECULAR FORMULA: C23H21N3O4
MOLECULAR WEIGHT: 403.43054
SMILES: C1CN(CCN1CCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C(=O)C5=CC=CO5
Structure:

CAS RN: 6238-81-9
CAS Name: 5-[(4-bromophenyl)-oxomethoxy]-2-methyl-3-benzofurancarboxylic acid methyl ester
OPENEYE Name: methyl 5-(4-bromobenzoyl)oxy-2-methyl-benzofuran-3-carboxylate
IUPAC Name: methyl 5-(4-bromobenzoyl)oxy-2-methyl-1-benzofuran-3-carboxylate
SYSTEMATIC NAME: methyl 5-(4-bromophenyl)carbonyloxy-2-methyl-1-benzofuran-3-carboxylate
MOLECULAR FORMULA: C18H13BrO5
MOLECULAR WEIGHT: 389.19682
SMILES: CC1=C(C2=C(O1)C=CC(=C2)OC(=O)C3=CC=C(C=C3)Br)C(=O)OC
Structure:

CAS RN: 6238-60-4
CAS Name: (2Z)-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-2-(2-oxo-1-prop-2-enyl-3-indolylidene)-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester
OPENEYE Name: methyl (2Z)-2-(1-allyl-2-oxo-indolin-3-ylidene)-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate
IUPAC Name: methyl (2Z)-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-2-(2-oxo-1-prop-2-enylindol-3-ylidene)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SYSTEMATIC NAME: methyl (2Z)-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxidanylidene-2-(2-oxidanylidene-1-prop-2-enyl-indol-3-ylidene)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
MOLECULAR FORMULA: C28H25N3O6S
MOLECULAR WEIGHT: 531.5796
SMILES: CC1=C(C(N2C(=O)/C(=C/3\C4=CC=CC=C4N(C3=O)CC=C)/SC2=N1)C5=CC(=C(C=C5)OC)OC)C(=O)OC
Structure:

CAS RN: 6238-51-3
CAS Name: 4-(3-bromo-5-ethoxy-4-methoxyphenyl)-3,4-dihydro-1H-benzo[h]quinolin-2-one
OPENEYE Name: 4-(3-bromo-5-ethoxy-4-methoxy-phenyl)-3,4-dihydro-1H-benzo[h]quinolin-2-one
IUPAC Name: 4-(3-bromo-5-ethoxy-4-methoxyphenyl)-3,4-dihydro-1H-benzo[h]quinolin-2-one
SYSTEMATIC NAME: 4-(3-bromanyl-5-ethoxy-4-methoxy-phenyl)-3,4-dihydro-1H-benzo[h]quinolin-2-one
MOLECULAR FORMULA: C22H20BrNO3
MOLECULAR WEIGHT: 426.3031
SMILES: CCOC1=C(C(=CC(=C1)C2CC(=O)NC3=C2C=CC4=CC=CC=C43)Br)OC
Structure:

CAS RN: 6238-40-0
CAS Name: 2-[[1-[1,3-benzodioxol-5-yl(oxo)methyl]-4-piperidinyl]methyl]benzo[de]isoquinoline-1,3-dione
OPENEYE Name: 2-[[1-(1,3-benzodioxole-5-carbonyl)-4-piperidyl]methyl]benzo[de]isoquinoline-1,3-dione
IUPAC Name: 2-[[1-(1,3-benzodioxole-5-carbonyl)piperidin-4-yl]methyl]benzo[de]isoquinoline-1,3-dione
SYSTEMATIC NAME: 2-[[1-(1,3-benzodioxol-5-ylcarbonyl)piperidin-4-yl]methyl]benzo[de]isoquinoline-1,3-dione
MOLECULAR FORMULA: C26H22N2O5
MOLECULAR WEIGHT: 442.46328
SMILES: C1CN(CCC1CN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C(=O)C5=CC6=C(C=C5)OCO6
Structure:

CAS RN: 6238-31-9
CAS Name: N-[(Z)-3-(2-furanylmethylamino)-1-[5-(3-nitrophenyl)-2-furanyl]-3-oxoprop-1-en-2-yl]-4-methoxybenzamide
OPENEYE Name: N-[(Z)-1-(2-furylmethylcarbamoyl)-2-[5-(3-nitrophenyl)-2-furyl]vinyl]-4-methoxy-benzamide
IUPAC Name: N-[(Z)-3-(furan-2-ylmethylamino)-1-[5-(3-nitrophenyl)furan-2-yl]-3-oxoprop-1-en-2-yl]-4-methoxybenzamide
SYSTEMATIC NAME: N-[(Z)-3-(furan-2-ylmethylamino)-1-[5-(3-nitrophenyl)furan-2-yl]-3-oxidanylidene-prop-1-en-2-yl]-4-methoxy-benzamide
MOLECULAR FORMULA: C26H21N3O7
MOLECULAR WEIGHT: 487.46084
SMILES: COC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC=C(O2)C3=CC(=CC=C3)[N+](=O)[O-])/C(=O)NCC4=CC=CO4
Structure:

CAS RN: 6238-17-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C17H13BrN4O3S2
MOLECULAR WEIGHT: 465.34412
SMILES: CSC1=NC2=C(C(C3=C(O2)N=C(NC3=O)SC)C4=CC=C(C=C4)Br)C(=O)N1
Structure:

CAS RN: 6238-15-9
CAS Name: 2-[[2-(4-chlorophenoxy)-1-oxoethyl]amino]-5-[(2,4-dimethoxyanilino)-oxomethyl]-4-methyl-3-thiophenecarboxylic acid ethyl ester
OPENEYE Name: ethyl 2-[[2-(4-chlorophenoxy)acetyl]amino]-5-[(2,4-dimethoxyphenyl)carbamoyl]-4-methyl-thiophene-3-carboxylate
IUPAC Name: ethyl 2-[[2-(4-chlorophenoxy)acetyl]amino]-5-[(2,4-dimethoxyphenyl)carbamoyl]-4-methylthiophene-3-carboxylate
SYSTEMATIC NAME: ethyl 2-[2-(4-chloranylphenoxy)ethanoylamino]-5-[(2,4-dimethoxyphenyl)carbamoyl]-4-methyl-thiophene-3-carboxylate
MOLECULAR FORMULA: C25H25ClN2O7S
MOLECULAR WEIGHT: 532.9932
SMILES: CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=C(C=C(C=C2)OC)OC)NC(=O)COC3=CC=C(C=C3)Cl
Structure:

CAS RN: 6238-13-7
CAS Name: 4-(4-hydroxy-3-nitrophenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid (phenylmethyl) ester
OPENEYE Name: benzyl 4-(4-hydroxy-3-nitro-phenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
IUPAC Name: benzyl 4-(4-hydroxy-3-nitrophenyl)-2-methyl-5-oxo-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
SYSTEMATIC NAME: (phenylmethyl) 2-methyl-4-(3-nitro-4-oxidanyl-phenyl)-5-oxidanylidene-7-phenyl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
MOLECULAR FORMULA: C30H26N2O6
MOLECULAR WEIGHT: 510.53724
SMILES: CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=CC(=C(C=C4)O)[N+](=O)[O-])C(=O)OCC5=CC=CC=C5
Structure:

CAS RN: 6238-10-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C19H16N2O9
MOLECULAR WEIGHT: 416.33834
SMILES: CC(=O)OC(C12C=CC(O1)C3C2C(=O)N(C3=O)C4=CC(=CC=C4)[N+](=O)[O-])OC(=O)C
Structure:

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