ethyl 1-[2,4-bis(fluoranyl)phenyl]-6-fluoranyl-7-[2-(4-methylphenyl)sulfonyl-1,3-dihydroisoindol-5-yl]-4-oxidanylidene-1,8-naphthyridine-3-carboxylate

Systemtic Name: ethyl 1-[2,4-bis(fluoranyl)phenyl]-6-fluoranyl-7-[2-(4-methylphenyl)sulfonyl-1,3-dihydroisoindol-5-yl]-4-oxidanylidene-1,8-naphthyridine-3-carboxylate Openeye Name: ethyl 1-(2,4-difluorophenyl)-6-fluoro-4-oxo-7-[2-(p-tolylsulfonyl)isoindolin-5-yl]-1,8-naphthyridine-3-carboxylate CAS Name: 1-(2,4-difluorophenyl)-6-fluoro-7-[2-(4-methylphenyl)sulfonyl-1,3-dihydroisoindol-5-yl]-4-oxo-1,8-naphthyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-(2,4-difluorophenyl)-6-fluoro-7-[2-(4-methylphenyl)sulfonyl-1,3-dihydroisoindol-5-yl]-4-oxo-1,8-naphthyridine-3-carboxylate Traditional Name: 1-(2,4-difluorophenyl)-6-fluoro-4-keto-7-(2-tosylisoindolin-5-yl)-1,8-naphthyridine-3-carboxylic acid ethyl ester Formula: C32H24F3N3O5S MolecularWeight: 619.61027

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=NC(=C(C=C2C1=O)F)C3=CC4=C(CN(C4)S(=O)(=O)C5=CC=C(C=C5)C)C=C3)C6=C(C=C(C=C6)F)F

Isomeric SMILES

CCOC(=O)C1=CN(C2=NC(=C(C=C2C1=O)F)C3=CC4=C(CN(C4)S(=O)(=O)C5=CC=C(C=C5)C)C=C3)C6=C(C=C(C=C6)F)F

InChI

InChI=1S/C32H24F3N3O5S/c1-3-43-32(40)25-17-38(28-11-8-22(33)13-26(28)34)31-24(30(25)39)14-27(35)29(36-31)19-6-7-20-15-37(16-21(20)12-19)44(41,42)23-9-4-18(2)5-10-23/h4-14,17H,3,15-16H2,1-2H3