Thursday, December 29, 2011

http://ChemLookup.com Compounds




CAS RN: 5477-78-1
CAS Name: 2-chloro-5-[[[4-chloro-3-[(3-methylphenyl)sulfamoyl]phenyl]-oxomethyl]amino]benzoic acid methyl ester
OPENEYE Name: methyl 2-chloro-5-[[4-chloro-3-(m-tolylsulfamoyl)benzoyl]amino]benzoate
IUPAC Name: methyl 2-chloro-5-[[4-chloro-3-[(3-methylphenyl)sulfamoyl]benzoyl]amino]benzoate
SYSTEMATIC NAME: methyl 2-chloranyl-5-[[4-chloranyl-3-[(3-methylphenyl)sulfamoyl]phenyl]carbonylamino]benzoate
MOLECULAR FORMULA: C22H18Cl2N2O5S
MOLECULAR WEIGHT: 493.35972
SMILES: CC1=CC(=CC=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC(=C(C=C3)Cl)C(=O)OC)Cl
Structure:

CAS RN: 5477-77-0
CAS Name: N-[2-(1-cyclohexenyl)ethyl]-4-methyl-3-[(3-methylphenyl)sulfamoyl]benzamide
OPENEYE Name: N-[2-(cyclohexen-1-yl)ethyl]-4-methyl-3-(m-tolylsulfamoyl)benzamide
IUPAC Name: N-[2-(cyclohexen-1-yl)ethyl]-4-methyl-3-[(3-methylphenyl)sulfamoyl]benzamide
SYSTEMATIC NAME: N-[2-(cyclohexen-1-yl)ethyl]-4-methyl-3-[(3-methylphenyl)sulfamoyl]benzamide
MOLECULAR FORMULA: C23H28N2O3S
MOLECULAR WEIGHT: 412.54502
SMILES: CC1=CC(=CC=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)NCCC3=CCCCC3)C
Structure:

CAS RN: 5477-76-9
CAS Name: N-(2,4-difluorophenyl)-4-[3-(2-furanylmethyl)-4-oxo-2-thiazolidinyl]benzamide
OPENEYE Name: N-(2,4-difluorophenyl)-4-[3-(2-furylmethyl)-4-oxo-thiazolidin-2-yl]benzamide
IUPAC Name: N-(2,4-difluorophenyl)-4-[3-(furan-2-ylmethyl)-4-oxo-1,3-thiazolidin-2-yl]benzamide
SYSTEMATIC NAME: N-[2,4-bis(fluoranyl)phenyl]-4-[3-(furan-2-ylmethyl)-4-oxidanylidene-1,3-thiazolidin-2-yl]benzamide
MOLECULAR FORMULA: C21H16F2N2O3S
MOLECULAR WEIGHT: 414.425146
SMILES: C1C(=O)N(C(S1)C2=CC=C(C=C2)C(=O)NC3=C(C=C(C=C3)F)F)CC4=CC=CO4
Structure:

CAS RN: 6587-95-7
CAS Name: 2-[3-(1,3-benzodioxol-5-ylmethyl)-2-(4-methoxyphenyl)imino-4-oxo-5-thiazolidinyl]-N-(2,5-dimethoxyphenyl)acetamide
OPENEYE Name: 2-[3-(1,3-benzodioxol-5-ylmethyl)-2-(4-methoxyphenyl)imino-4-oxo-thiazolidin-5-yl]-N-(2,5-dimethoxyphenyl)acetamide
IUPAC Name: 2-[3-(1,3-benzodioxol-5-ylmethyl)-2-(4-methoxyphenyl)imino-4-oxo-1,3-thiazolidin-5-yl]-N-(2,5-dimethoxyphenyl)acetamide
SYSTEMATIC NAME: 2-[3-(1,3-benzodioxol-5-ylmethyl)-2-(4-methoxyphenyl)imino-4-oxidanylidene-1,3-thiazolidin-5-yl]-N-(2,5-dimethoxyphenyl)ethanamide
MOLECULAR FORMULA: C28H27N3O7S
MOLECULAR WEIGHT: 549.59488
SMILES: COC1=CC=C(C=C1)N=C2N(C(=O)C(S2)CC(=O)NC3=C(C=CC(=C3)OC)OC)CC4=CC5=C(C=C4)OCO5
Structure:

CAS RN: 69975-38-8
CAS Name: acetic acid [4-acetamido-2-(azidomethyl)-6-methoxy-3-oxanyl] ester
OPENEYE Name: [4-acetamido-2-(azidomethyl)-6-methoxy-tetrahydropyran-3-yl] acetate
IUPAC Name: [4-acetamido-2-(azidomethyl)-6-methoxyoxan-3-yl] acetate
SYSTEMATIC NAME: [4-acetamido-2-(azidomethyl)-6-methoxy-oxan-3-yl] ethanoate
MOLECULAR FORMULA: C11H18N4O5
MOLECULAR WEIGHT: 286.28442
SMILES: CC(=O)NC1CC(OC(C1OC(=O)C)CN=[N+]=[N-])OC
Structure:

CAS RN: 5957-41-5
CAS Name: N-[2-[4-(4-chlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-N-(3-methoxypropyl)-3,5,5-trimethylhexanamide
OPENEYE Name: N-[2-[4-(4-chlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxo-ethyl]-N-(3-methoxypropyl)-3,5,5-trimethyl-hexanamide
IUPAC Name: N-[2-[4-(4-chlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxoethyl]-N-(3-methoxypropyl)-3,5,5-trimethylhexanamide
SYSTEMATIC NAME: N-[2-[4-(4-chlorophenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2-oxidanylidene-ethyl]-N-(3-methoxypropyl)-3,5,5-trimethyl-hexanamide
MOLECULAR FORMULA: C28H39ClN2O3S
MOLECULAR WEIGHT: 519.13886
SMILES: CC(CC(=O)N(CCCOC)CC(=O)N1CCC2=C(C1C3=CC=C(C=C3)Cl)C=CS2)CC(C)(C)C
Structure:

CAS RN: 6381-47-1
CAS Name: N-(4-bromophenyl)carbamic acid methyl ester
OPENEYE Name: methyl N-(4-bromophenyl)carbamate
IUPAC Name: methyl N-(4-bromophenyl)carbamate
SYSTEMATIC NAME: methyl N-(4-bromophenyl)carbamate
MOLECULAR FORMULA: C8H8BrNO2
MOLECULAR WEIGHT: 230.05862
SMILES: COC(=O)NC1=CC=C(C=C1)Br
Structure:

CAS RN: 6181-70-0
CAS Name: 2-chloro-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-6-fluorobenzamide
OPENEYE Name: 2-chloro-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-6-fluoro-benzamide
IUPAC Name: 2-chloro-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-6-fluorobenzamide
SYSTEMATIC NAME: 2-chloranyl-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-6-fluoranyl-benzamide
MOLECULAR FORMULA: C11H9ClFN3OS2
MOLECULAR WEIGHT: 317.790063
SMILES: CCSC1=NN=C(S1)NC(=O)C2=C(C=CC=C2Cl)F
Structure:

CAS RN: 5843-81-2
CAS Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-2-(3-methylphenoxy)acetamide
OPENEYE Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methyleneamino]-2-(3-methylphenoxy)acetamide
IUPAC Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-2-(3-methylphenoxy)acetamide
SYSTEMATIC NAME: N-[(6-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-2-(3-methylphenoxy)ethanamide
MOLECULAR FORMULA: C17H15BrN2O4
MOLECULAR WEIGHT: 391.216
SMILES: CC1=CC(=CC=C1)OCC(=O)NN=CC2=CC3=C(C=C2Br)OCO3
Structure:

CAS RN: 6172-99-2
CAS Name: N'-(cyclohexylideneamino)-N-(2-ethoxyphenyl)oxamide
OPENEYE Name: N'-(cyclohexylideneamino)-N-(2-ethoxyphenyl)oxamide
IUPAC Name: N'-(cyclohexylideneamino)-N-(2-ethoxyphenyl)oxamide
SYSTEMATIC NAME: N'-(cyclohexylideneamino)-N-(2-ethoxyphenyl)ethanediamide
MOLECULAR FORMULA: C16H21N3O3
MOLECULAR WEIGHT: 303.35624
SMILES: CCOC1=CC=CC=C1NC(=O)C(=O)NN=C2CCCCC2
Structure:

CAS RN: 6268-77-5
CAS Name: N-[3-(1,3-benzothiazol-2-yl)-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridin-2-yl]-3-methoxy-2-naphthalenecarboxamide
OPENEYE Name: N-[3-(1,3-benzothiazol-2-yl)-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridin-2-yl]-3-methoxy-naphthalene-2-carboxamide
IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridin-2-yl]-3-methoxynaphthalene-2-carboxamide
SYSTEMATIC NAME: N-[3-(1,3-benzothiazol-2-yl)-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridin-2-yl]-3-methoxy-naphthalene-2-carboxamide
MOLECULAR FORMULA: C30H29N3O2S2
MOLECULAR WEIGHT: 527.70016
SMILES: CC1(CC2=C(C(N1)(C)C)SC(=C2C3=NC4=CC=CC=C4S3)NC(=O)C5=CC6=CC=CC=C6C=C5OC)C
Structure:

CAS RN: 6268-16-2
CAS Name: N-(6-acetyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)-3,4,5-triethoxybenzamide
OPENEYE Name: N-(6-acetyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)-3,4,5-triethoxy-benzamide
IUPAC Name: N-(6-acetyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)-3,4,5-triethoxybenzamide
SYSTEMATIC NAME: N-(3-cyano-6-ethanoyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)-3,4,5-triethoxy-benzamide
MOLECULAR FORMULA: C23H27N3O5S
MOLECULAR WEIGHT: 457.54258
SMILES: CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=C(C3=C(S2)CN(CC3)C(=O)C)C#N
Structure:

CAS RN: 6265-71-0
CAS Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-4-[(3-methyl-1-piperidinyl)sulfonyl]benzamide
OPENEYE Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-4-[(3-methyl-1-piperidyl)sulfonyl]benzamide
IUPAC Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-4-(3-methylpiperidin-1-yl)sulfonylbenzamide
SYSTEMATIC NAME: N-(6-fluoranyl-1,3-benzothiazol-2-yl)-4-(3-methylpiperidin-1-yl)sulfonyl-benzamide
MOLECULAR FORMULA: C20H20FN3O3S2
MOLECULAR WEIGHT: 433.519503
SMILES: CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)F
Structure:

CAS RN: 5068-23-5
CAS Name: 6,7-diethoxy-1-(4-methoxy-3-propan-2-ylphenyl)-1,2,3,4-tetrahydroisoquinoline
OPENEYE Name: 6,7-diethoxy-1-(3-isopropyl-4-methoxy-phenyl)-1,2,3,4-tetrahydroisoquinoline
IUPAC Name: 6,7-diethoxy-1-(4-methoxy-3-propan-2-ylphenyl)-1,2,3,4-tetrahydroisoquinoline
SYSTEMATIC NAME: 6,7-diethoxy-1-(4-methoxy-3-propan-2-yl-phenyl)-1,2,3,4-tetrahydroisoquinoline
MOLECULAR FORMULA: C23H31NO3
MOLECULAR WEIGHT: 369.49714
SMILES: CCOC1=C(C=C2C(NCCC2=C1)C3=CC(=C(C=C3)OC)C(C)C)OCC
Structure:

CAS RN: 5935-47-7
CAS Name: 3-(3-methylphenyl)-1-[[1-[(3-methylphenyl)methyl]-2-pyrrolyl]methyl]-1-prop-2-enylurea
OPENEYE Name: 1-allyl-3-(m-tolyl)-1-[[1-(m-tolylmethyl)pyrrol-2-yl]methyl]urea
IUPAC Name: 3-(3-methylphenyl)-1-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-1-prop-2-enylurea
SYSTEMATIC NAME: 3-(3-methylphenyl)-1-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-1-prop-2-enyl-urea
MOLECULAR FORMULA: C24H27N3O
MOLECULAR WEIGHT: 373.49068
SMILES: CC1=CC(=CC=C1)CN2C=CC=C2CN(CC=C)C(=O)NC3=CC=CC(=C3)C
Structure:

CAS RN: 5932-41-2
CAS Name: 5-[[cyclohexyl-[(3-methylphenyl)methyl]amino]methyl]-N-[2-(dimethylamino)ethyl]-2-furancarboxamide
OPENEYE Name: 5-[[cyclohexyl(m-tolylmethyl)amino]methyl]-N-[2-(dimethylamino)ethyl]furan-2-carboxamide
IUPAC Name: 5-[[cyclohexyl-[(3-methylphenyl)methyl]amino]methyl]-N-[2-(dimethylamino)ethyl]furan-2-carboxamide
SYSTEMATIC NAME: 5-[[cyclohexyl-[(3-methylphenyl)methyl]amino]methyl]-N-[2-(dimethylamino)ethyl]furan-2-carboxamide
MOLECULAR FORMULA: C24H35N3O2
MOLECULAR WEIGHT: 397.5536
SMILES: CC1=CC(=CC=C1)CN(CC2=CC=C(O2)C(=O)NCCN(C)C)C3CCCCC3
Structure:

CAS RN: 5928-73-4
CAS Name: 2-(3-methylphenyl)-8-phenylmethoxy-N-(2,4,4-trimethylpentan-2-yl)-3-imidazo[1,2-a]pyridinamine
OPENEYE Name: 8-benzyloxy-2-(m-tolyl)-N-(1,1,3,3-tetramethylbutyl)imidazo[1,2-a]pyridin-3-amine
IUPAC Name: 2-(3-methylphenyl)-8-phenylmethoxy-N-(2,4,4-trimethylpentan-2-yl)imidazo[1,2-a]pyridin-3-amine
SYSTEMATIC NAME: 2-(3-methylphenyl)-8-phenylmethoxy-N-(2,4,4-trimethylpentan-2-yl)imidazo[1,2-a]pyridin-3-amine
MOLECULAR FORMULA: C29H35N3O
MOLECULAR WEIGHT: 441.6077
SMILES: CC1=CC=CC(=C1)C2=C(N3C=CC=C(C3=N2)OCC4=CC=CC=C4)NC(C)(C)CC(C)(C)C
Structure:

CAS RN: 5288-58-4
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C23H22N4O5S
MOLECULAR WEIGHT: 466.50958
SMILES: CCOC(=O)C1=C(OC2=C(C13C4=CC=CC5=C4N(C3=O)C(C=C5C)(C)C)C(=O)NC(=S)N2)N
Structure:

CAS RN: 6282-45-7
CAS Name: N-[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-3-phenyl-2-propenamide
OPENEYE Name: N-[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-3-phenyl-prop-2-enamide
IUPAC Name: N-[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-3-phenylprop-2-enamide
SYSTEMATIC NAME: N-[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-3-phenyl-prop-2-enamide
MOLECULAR FORMULA: C18H15N3O3
MOLECULAR WEIGHT: 321.33
SMILES: COC1=CC=CC=C1C2=NN=C(O2)NC(=O)C=CC3=CC=CC=C3
Structure:

CAS RN: 6783-12-6
CAS Name: acetic acid [3-[(2,4-dimethoxyanilino)-oxomethyl]-2-(2,4-dimethoxyphenyl)imino-8-methyl-5-pyrano[2,3-c]pyridinyl]methyl ester
OPENEYE Name: [3-[(2,4-dimethoxyphenyl)carbamoyl]-2-(2,4-dimethoxyphenyl)imino-8-methyl-pyrano[2,3-c]pyridin-5-yl]methyl acetate
IUPAC Name: [3-[(2,4-dimethoxyphenyl)carbamoyl]-2-(2,4-dimethoxyphenyl)imino-8-methylpyrano[2,3-c]pyridin-5-yl]methyl acetate
SYSTEMATIC NAME: [3-[(2,4-dimethoxyphenyl)carbamoyl]-2-(2,4-dimethoxyphenyl)imino-8-methyl-pyrano[2,3-c]pyridin-5-yl]methyl ethanoate
MOLECULAR FORMULA: C29H29N3O8
MOLECULAR WEIGHT: 547.55586
SMILES: CC1=NC=C(C2=C1OC(=NC3=C(C=C(C=C3)OC)OC)C(=C2)C(=O)NC4=C(C=C(C=C4)OC)OC)COC(=O)C
Structure:

CAS RN: 6263-25-8
CAS Name: 2,5-dichloro-N-(6-fluoro-3-methyl-1,3-benzothiazol-2-ylidene)benzamide
OPENEYE Name: 2,5-dichloro-N-(6-fluoro-3-methyl-1,3-benzothiazol-2-ylidene)benzamide
IUPAC Name: 2,5-dichloro-N-(6-fluoro-3-methyl-1,3-benzothiazol-2-ylidene)benzamide
SYSTEMATIC NAME: 2,5-bis(chloranyl)-N-(6-fluoranyl-3-methyl-1,3-benzothiazol-2-ylidene)benzamide
MOLECULAR FORMULA: C15H9Cl2FN2OS
MOLECULAR WEIGHT: 355.214163
SMILES: CN1C2=C(C=C(C=C2)F)SC1=NC(=O)C3=C(C=CC(=C3)Cl)Cl
Structure:

CAS RN: 6385-19-9
CAS Name: N-(3-methylbutan-2-ylideneamino)-2-thiophenecarboxamide
OPENEYE Name: N-(1,2-dimethylpropylideneamino)thiophene-2-carboxamide
IUPAC Name: N-(3-methylbutan-2-ylideneamino)thiophene-2-carboxamide
SYSTEMATIC NAME: N-(3-methylbutan-2-ylideneamino)thiophene-2-carboxamide
MOLECULAR FORMULA: C10H14N2OS
MOLECULAR WEIGHT: 210.29596
SMILES: CC(C)C(=NNC(=O)C1=CC=CS1)C
Structure:

CAS RN: 6069-08-5
CAS Name: 6-(4-hydroxy-2-methoxyphenyl)-8-(4-methylanilino)-2-(3-nitrophenyl)-6a-phenyl-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone
OPENEYE Name: 6-(4-hydroxy-2-methoxy-phenyl)-8-(4-methylanilino)-2-(3-nitrophenyl)-6a-phenyl-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone
IUPAC Name: 6-(4-hydroxy-2-methoxyphenyl)-8-(4-methylanilino)-2-(3-nitrophenyl)-6a-phenyl-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone
SYSTEMATIC NAME: 6-(2-methoxy-4-oxidanyl-phenyl)-8-[(4-methylphenyl)amino]-2-(3-nitrophenyl)-6a-phenyl-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone
MOLECULAR FORMULA: C40H34N4O8
MOLECULAR WEIGHT: 698.71996
SMILES: CC1=CC=C(C=C1)NN2C(=O)C3CC4C5C(CC=C4C(C3(C2=O)C6=CC=CC=C6)C7=C(C=C(C=C7)O)OC)C(=O)N(C5=O)C8=CC(=CC=C8)[N+](=O)[O-]
Structure:

CAS RN: 6066-63-3
CAS Name: 6a-(4-chlorophenyl)-6-(2,3-dibromo-4-hydroxy-5-methoxyphenyl)-8-(4-fluoroanilino)-2-(phenylmethyl)-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone
OPENEYE Name: 2-benzyl-6a-(4-chlorophenyl)-6-(2,3-dibromo-4-hydroxy-5-methoxy-phenyl)-8-(4-fluoroanilino)-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone
IUPAC Name: 2-benzyl-6a-(4-chlorophenyl)-6-(2,3-dibromo-4-hydroxy-5-methoxyphenyl)-8-(4-fluoroanilino)-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone
SYSTEMATIC NAME: 6-[2,3-bis(bromanyl)-5-methoxy-4-oxidanyl-phenyl]-6a-(4-chlorophenyl)-8-[(4-fluorophenyl)amino]-2-(phenylmethyl)-4,6,9a,10,10a,10b-hexahydro-3aH-isoindolo[5,6-e]isoindole-1,3,7,9-tetrone
MOLECULAR FORMULA: C40H31Br2ClFN3O6
MOLECULAR WEIGHT: 863.950043
SMILES: COC1=C(C(=C(C(=C1)C2C3=CCC4C(C3CC5C2(C(=O)N(C5=O)NC6=CC=C(C=C6)F)C7=CC=C(C=C7)Cl)C(=O)N(C4=O)CC8=CC=CC=C8)Br)Br)O
Structure:

CAS RN: 6664-60-4
CAS Name: 1-(2-chloro-4-nitrophenyl)-3-(dimethylamino)urea
OPENEYE Name: 1-(2-chloro-4-nitro-phenyl)-3-(dimethylamino)urea
IUPAC Name: 1-(2-chloro-4-nitrophenyl)-3-(dimethylamino)urea
SYSTEMATIC NAME: 1-(2-chloranyl-4-nitro-phenyl)-3-(dimethylamino)urea
MOLECULAR FORMULA: C9H11ClN4O3
MOLECULAR WEIGHT: 258.66164
SMILES: CN(C)NC(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])Cl
Structure:

CAS RN: 6207-94-9
CAS Name: 1-(4-chlorophenyl)-N-(5-chloro-2-pyridinyl)-7,7-dimethyl-2,5-dioxo-6,8-dihydroquinoline-3-carboxamide
OPENEYE Name: 1-(4-chlorophenyl)-N-(5-chloro-2-pyridyl)-7,7-dimethyl-2,5-dioxo-6,8-dihydroquinoline-3-carboxamide
IUPAC Name: 1-(4-chlorophenyl)-N-(5-chloropyridin-2-yl)-7,7-dimethyl-2,5-dioxo-6,8-dihydroquinoline-3-carboxamide
SYSTEMATIC NAME: N-(5-chloranylpyridin-2-yl)-1-(4-chlorophenyl)-7,7-dimethyl-2,5-bis(oxidanylidene)-6,8-dihydroquinoline-3-carboxamide
MOLECULAR FORMULA: C23H19Cl2N3O3
MOLECULAR WEIGHT: 456.32126
SMILES: CC1(CC2=C(C=C(C(=O)N2C3=CC=C(C=C3)Cl)C(=O)NC4=NC=C(C=C4)Cl)C(=O)C1)C
Structure:

CAS RN: 5573-22-8
CAS Name: 4-[[4-[[4-(diethylamino)phenyl]-[4-[ethyl-[(4-sulfonatophenyl)methyl]iminio]-1-cyclohexa-2,5-dienylidene]methyl]-N-ethylanilino]methyl]benzenesulfonate
OPENEYE Name: 4-[[4-[[4-(diethylamino)phenyl]-[4-[ethyl-[(4-sulfonatophenyl)methyl]iminio]cyclohexa-2,5-dien-1-ylidene]methyl]-N-ethyl-anilino]methyl]benzenesulfonate
IUPAC Name: 4-[[4-[[4-(diethylamino)phenyl]-[4-[ethyl-[(4-sulfonatophenyl)methyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]methyl]-N-ethylanilino]methyl]benzenesulfonate
SYSTEMATIC NAME: 4-[[[4-[[4-(diethylamino)phenyl]-[4-[ethyl-[(4-sulfonatophenyl)methyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]methyl]phenyl]-ethyl-amino]methyl]benzenesulfonate
MOLECULAR FORMULA: C41H44N3O6S2-
MOLECULAR WEIGHT: 738.93456
SMILES: CCN(CC)C1=CC=C(C=C1)C(=C2C=CC(=[N+](CC)CC3=CC=C(C=C3)S(=O)(=O)[O-])C=C2)C4=CC=C(C=C4)N(CC)CC5=CC=C(C=C5)S(=O)(=O)[O-]
Structure:

CAS RN: 6382-74-7
CAS Name: 4-bromo-N-[4-[(4-methyl-1-piperidinyl)-oxomethyl]phenyl]benzamide
OPENEYE Name: 4-bromo-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]benzamide
IUPAC Name: 4-bromo-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]benzamide
SYSTEMATIC NAME: 4-bromanyl-N-[4-(4-methylpiperidin-1-yl)carbonylphenyl]benzamide
MOLECULAR FORMULA: C20H21BrN2O2
MOLECULAR WEIGHT: 401.29694
SMILES: CC1CCN(CC1)C(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)Br
Structure:

CAS RN: 5317-97-5
CAS Name: 3-[5-[[3-ethoxy-5-iodo-4-[(4-nitrophenyl)methoxy]phenyl]methylidene]-4,6-dioxo-2-sulfanylidene-1,3-diazinan-1-yl]benzoic acid
OPENEYE Name: 3-[5-[[3-ethoxy-5-iodo-4-[(4-nitrophenyl)methoxy]phenyl]methylene]-4,6-dioxo-2-thioxo-hexahydropyrimidin-1-yl]benzoic acid
IUPAC Name: 3-[5-[[3-ethoxy-5-iodo-4-[(4-nitrophenyl)methoxy]phenyl]methylidene]-4,6-dioxo-2-sulfanylidene-1,3-diazinan-1-yl]benzoic acid
SYSTEMATIC NAME: 3-[5-[[3-ethoxy-5-iodanyl-4-[(4-nitrophenyl)methoxy]phenyl]methylidene]-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-1-yl]benzoic acid
MOLECULAR FORMULA: C27H20IN3O8S
MOLECULAR WEIGHT: 673.43247
SMILES: CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=S)N(C2=O)C3=CC=CC(=C3)C(=O)O)I)OCC4=CC=C(C=C4)[N+](=O)[O-]
Structure:

CAS RN: 5317-36-2
CAS Name: N-[6-methyl-2-(4-propan-2-ylphenyl)-5-benzotriazolyl]-3-nitro-4-(1-piperidinyl)benzamide
OPENEYE Name: N-[2-(4-isopropylphenyl)-6-methyl-benzotriazol-5-yl]-3-nitro-4-(1-piperidyl)benzamide
IUPAC Name: N-[6-methyl-2-(4-propan-2-ylphenyl)benzotriazol-5-yl]-3-nitro-4-piperidin-1-ylbenzamide
SYSTEMATIC NAME: N-[6-methyl-2-(4-propan-2-ylphenyl)benzotriazol-5-yl]-3-nitro-4-piperidin-1-yl-benzamide
MOLECULAR FORMULA: C28H30N6O3
MOLECULAR WEIGHT: 498.5762
SMILES: CC1=CC2=NN(N=C2C=C1NC(=O)C3=CC(=C(C=C3)N4CCCCC4)[N+](=O)[O-])C5=CC=C(C=C5)C(C)C
Structure:

CAS RN: 5314-91-0
CAS Name: 2-[[4-[(3-cyclohexyl-2-cyclohexylimino-4-oxo-5-thiazolidinylidene)methyl]-2-iodophenoxy]methyl]benzonitrile
OPENEYE Name: 2-[[4-[(3-cyclohexyl-2-cyclohexylimino-4-oxo-thiazolidin-5-ylidene)methyl]-2-iodo-phenoxy]methyl]benzonitrile
IUPAC Name: 2-[[4-[(3-cyclohexyl-2-cyclohexylimino-4-oxo-1,3-thiazolidin-5-ylidene)methyl]-2-iodophenoxy]methyl]benzonitrile
SYSTEMATIC NAME: 2-[[4-[(3-cyclohexyl-2-cyclohexylimino-4-oxidanylidene-1,3-thiazolidin-5-ylidene)methyl]-2-iodanyl-phenoxy]methyl]benzenecarbonitrile
MOLECULAR FORMULA: C30H32IN3O2S
MOLECULAR WEIGHT: 625.56345
SMILES: C1CCC(CC1)N=C2N(C(=O)C(=CC3=CC(=C(C=C3)OCC4=CC=CC=C4C#N)I)S2)C5CCCCC5
Structure:

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