2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfonyl-N-quinolin-8-yl-butanamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-4-methylsulfonyl-N-quinolin-8-yl-butanamide Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)-4-methylsulfonyl-N-(8-quinolyl)butanamide CAS Name: 2-(1,3-dioxo-2-isoindolyl)-4-methylsulfonyl-N-(8-quinolinyl)butanamide IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)-4-methylsulfonyl-N-quinolin-8-ylbutanamide Traditional Name: 4-mesyl-2-phthalimido-N-(8-quinolyl)butyramide Formula: C22H19N3O5S MolecularWeight: 437.46836

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)NC1=CC=CC2=C1N=CC=C2)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CS(=O)(=O)CCC(C(=O)NC1=CC=CC2=C1N=CC=C2)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H19N3O5S/c1-31(29,30)13-11-18(25-21(27)15-8-2-3-9-16(15)22(25)28)20(26)24-17-10-4-6-14-7-5-12-23-19(14)17/h2-10,12,18H,11,13H2,1H3,(H,24,26)