N-(2,5-diethoxyphenyl)-4-methylsulfonyl-2-(3-oxidanylidene-1H-isoindol-2-yl)butanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)OCC)NC(=O)C(CCS(=O)(=O)C)N2CC3=CC=CC=C3C2=O

Isomeric SMILES

CCOC1=CC(=C(C=C1)OCC)NC(=O)C(CCS(=O)(=O)C)N2CC3=CC=CC=C3C2=O

InChI

InChI=1S/C23H28N2O6S/c1-4-30-17-10-11-21(31-5-2)19(14-17)24-22(26)20(12-13-32(3,28)29)25-15-16-8-6-7-9-18(16)23(25)27/h6-11,14,20H,4-5,12-13,15H2,1-3H3,(H,24,26)