N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-4-methylsulfonyl-2-(3-oxidanylidene-1H-isoindol-2-yl)butanamide

Systemtic Name: N-(4-chloranyl-2-methoxy-5-methyl-phenyl)-4-methylsulfonyl-2-(3-oxidanylidene-1H-isoindol-2-yl)butanamide Openeye Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-4-methylsulfonyl-2-(1-oxoisoindolin-2-yl)butanamide CAS Name: N-(4-chloro-2-methoxy-5-methylphenyl)-4-methylsulfonyl-2-(3-oxo-1H-isoindol-2-yl)butanamide IUPAC Name: N-(4-chloro-2-methoxy-5-methylphenyl)-4-methylsulfonyl-2-(3-oxo-1H-isoindol-2-yl)butanamide Traditional Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-(1-ketoisoindolin-2-yl)-4-mesyl-butyramide Formula: C21H23ClN2O5S MolecularWeight: 450.93572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)C(CCS(=O)(=O)C)N2CC3=CC=CC=C3C2=O

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)C(CCS(=O)(=O)C)N2CC3=CC=CC=C3C2=O

InChI

InChI=1S/C21H23ClN2O5S/c1-13-10-17(19(29-2)11-16(13)22)23-20(25)18(8-9-30(3,27)28)24-12-14-6-4-5-7-15(14)21(24)26/h4-7,10-11,18H,8-9,12H2,1-3H3,(H,23,25)