4-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(3-methylsulfonylphenyl)butanamide

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(3-methylsulfonylphenyl)butanamide Openeye Name: 4-(1,3-dioxoisoindolin-2-yl)-N-(3-methylsulfonylphenyl)butanamide CAS Name: 4-(1,3-dioxo-2-isoindolyl)-N-(3-methylsulfonylphenyl)butanamide IUPAC Name: 4-(1,3-dioxoisoindol-2-yl)-N-(3-methylsulfonylphenyl)butanamide Traditional Name: N-(3-mesylphenyl)-4-phthalimido-butyramide Formula: C19H18N2O5S MolecularWeight: 386.42162

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)NC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)NC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C19H18N2O5S/c1-27(25,26)14-7-4-6-13(12-14)20-17(22)10-5-11-21-18(23)15-8-2-3-9-16(15)19(21)24/h2-4,6-9,12H,5,10-11H2,1H3,(H,20,22)