N-[4-[2-[2-(5-chloranyl-3-oxidanylidene-1H-isoindol-2-yl)ethyl-methyl-amino]ethanoyl]phenyl]methanesulfonamide

Systemtic Name: N-[4-[2-[2-(5-chloranyl-3-oxidanylidene-1H-isoindol-2-yl)ethyl-methyl-amino]ethanoyl]phenyl]methanesulfonamide Openeye Name: N-[4-[2-[2-(6-chloro-1-oxo-isoindolin-2-yl)ethyl-methyl-amino]acetyl]phenyl]methanesulfonamide CAS Name: N-[4-[2-[2-(5-chloro-3-oxo-1H-isoindol-2-yl)ethyl-methylamino]-1-oxoethyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[2-[2-(5-chloro-3-oxo-1H-isoindol-2-yl)ethyl-methylamino]acetyl]phenyl]methanesulfonamide Traditional Name: N-[4-[2-[2-(6-chloro-1-keto-isoindolin-2-yl)ethyl-methyl-amino]acetyl]phenyl]methanesulfonamide Formula: C20H22ClN3O4S MolecularWeight: 435.92438

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCN1CC2=C(C1=O)C=C(C=C2)Cl)CC(=O)C3=CC=C(C=C3)NS(=O)(=O)C

Isomeric SMILES

CN(CCN1CC2=C(C1=O)C=C(C=C2)Cl)CC(=O)C3=CC=C(C=C3)NS(=O)(=O)C

InChI

InChI=1S/C20H22ClN3O4S/c1-23(9-10-24-12-15-3-6-16(21)11-18(15)20(24)26)13-19(25)14-4-7-17(8-5-14)22-29(2,27)28/h3-8,11,22H,9-10,12-13H2,1-2H3