N-[2-(4-methylpiperazin-1-yl)ethyl]-4-methylsulfonyl-2-(3-oxidanylidene-1H-isoindol-2-yl)butanamide

Systemtic Name: N-[2-(4-methylpiperazin-1-yl)ethyl]-4-methylsulfonyl-2-(3-oxidanylidene-1H-isoindol-2-yl)butanamide Openeye Name: N-[2-(4-methylpiperazin-1-yl)ethyl]-4-methylsulfonyl-2-(1-oxoisoindolin-2-yl)butanamide CAS Name: N-[2-(4-methyl-1-piperazinyl)ethyl]-4-methylsulfonyl-2-(3-oxo-1H-isoindol-2-yl)butanamide IUPAC Name: N-[2-(4-methylpiperazin-1-yl)ethyl]-4-methylsulfonyl-2-(3-oxo-1H-isoindol-2-yl)butanamide Traditional Name: 2-(1-ketoisoindolin-2-yl)-4-mesyl-N-[2-(4-methylpiperazino)ethyl]butyramide Formula: C20H30N4O4S MolecularWeight: 422.5416

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCNC(=O)C(CCS(=O)(=O)C)N2CC3=CC=CC=C3C2=O

Isomeric SMILES

CN1CCN(CC1)CCNC(=O)C(CCS(=O)(=O)C)N2CC3=CC=CC=C3C2=O

InChI

InChI=1S/C20H30N4O4S/c1-22-10-12-23(13-11-22)9-8-21-19(25)18(7-14-29(2,27)28)24-15-16-5-3-4-6-17(16)20(24)26/h3-6,18H,7-15H2,1-2H3,(H,21,25)