N-[2-(2,5-dimethoxyphenyl)ethyl]-4-methylsulfonyl-2-(3-oxidanylidene-1H-isoindol-2-yl)butanamide

Systemtic Name: N-[2-(2,5-dimethoxyphenyl)ethyl]-4-methylsulfonyl-2-(3-oxidanylidene-1H-isoindol-2-yl)butanamide Openeye Name: N-[2-(2,5-dimethoxyphenyl)ethyl]-4-methylsulfonyl-2-(1-oxoisoindolin-2-yl)butanamide CAS Name: N-[2-(2,5-dimethoxyphenyl)ethyl]-4-methylsulfonyl-2-(3-oxo-1H-isoindol-2-yl)butanamide IUPAC Name: N-[2-(2,5-dimethoxyphenyl)ethyl]-4-methylsulfonyl-2-(3-oxo-1H-isoindol-2-yl)butanamide Traditional Name: N-[2-(2,5-dimethoxyphenyl)ethyl]-2-(1-ketoisoindolin-2-yl)-4-mesyl-butyramide Formula: C23H28N2O6S MolecularWeight: 460.54322

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CCNC(=O)C(CCS(=O)(=O)C)N2CC3=CC=CC=C3C2=O

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CCNC(=O)C(CCS(=O)(=O)C)N2CC3=CC=CC=C3C2=O

InChI

InChI=1S/C23H28N2O6S/c1-30-18-8-9-21(31-2)16(14-18)10-12-24-22(26)20(11-13-32(3,28)29)25-15-17-6-4-5-7-19(17)23(25)27/h4-9,14,20H,10-13,15H2,1-3H3,(H,24,26)