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

Systemtic Name: N-[(3-methoxyphenyl)methyl]-4-methylsulfonyl-2-(3-oxidanylidene-1H-isoindol-2-yl)butanamide Openeye Name: N-[(3-methoxyphenyl)methyl]-4-methylsulfonyl-2-(1-oxoisoindolin-2-yl)butanamide CAS Name: N-[(3-methoxyphenyl)methyl]-4-methylsulfonyl-2-(3-oxo-1H-isoindol-2-yl)butanamide IUPAC Name: N-[(3-methoxyphenyl)methyl]-4-methylsulfonyl-2-(3-oxo-1H-isoindol-2-yl)butanamide Traditional Name: 2-(1-ketoisoindolin-2-yl)-N-m-anisyl-4-mesyl-butyramide Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC(=O)C(CCS(=O)(=O)C)N2CC3=CC=CC=C3C2=O

Isomeric SMILES

COC1=CC=CC(=C1)CNC(=O)C(CCS(=O)(=O)C)N2CC3=CC=CC=C3C2=O

InChI

InChI=1S/C21H24N2O5S/c1-28-17-8-5-6-15(12-17)13-22-20(24)19(10-11-29(2,26)27)23-14-16-7-3-4-9-18(16)21(23)25/h3-9,12,19H,10-11,13-14H2,1-2H3,(H,22,24)