2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(6-chloranylquinolin-8-yl)-4-methylsulfonyl-butanamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(6-chloranylquinolin-8-yl)-4-methylsulfonyl-butanamide Openeye Name: N-(6-chloro-8-quinolyl)-2-(1,3-dioxoisoindolin-2-yl)-4-methylsulfonyl-butanamide CAS Name: N-(6-chloro-8-quinolinyl)-2-(1,3-dioxo-2-isoindolyl)-4-methylsulfonylbutanamide IUPAC Name: N-(6-chloroquinolin-8-yl)-2-(1,3-dioxoisoindol-2-yl)-4-methylsulfonylbutanamide Traditional Name: N-(6-chloro-8-quinolyl)-4-mesyl-2-phthalimido-butyramide Formula: C22H18ClN3O5S MolecularWeight: 471.91342

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)NC1=C2C(=CC(=C1)Cl)C=CC=N2)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CS(=O)(=O)CCC(C(=O)NC1=C2C(=CC(=C1)Cl)C=CC=N2)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H18ClN3O5S/c1-32(30,31)10-8-18(26-21(28)15-6-2-3-7-16(15)22(26)29)20(27)25-17-12-14(23)11-13-5-4-9-24-19(13)17/h2-7,9,11-12,18H,8,10H2,1H3,(H,25,27)