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

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(4-butan-2-ylphenyl)-4-methylsulfonyl-butanamide Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)-4-methylsulfonyl-N-(4-sec-butylphenyl)butanamide CAS Name: N-(4-butan-2-ylphenyl)-2-(1,3-dioxo-2-isoindolyl)-4-methylsulfonylbutanamide IUPAC Name: N-(4-butan-2-ylphenyl)-2-(1,3-dioxoisoindol-2-yl)-4-methylsulfonylbutanamide Traditional Name: 4-mesyl-2-phthalimido-N-(4-sec-butylphenyl)butyramide Formula: C23H26N2O5S MolecularWeight: 442.52794

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=O)C(CCS(=O)(=O)C)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=O)C(CCS(=O)(=O)C)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C23H26N2O5S/c1-4-15(2)16-9-11-17(12-10-16)24-21(26)20(13-14-31(3,29)30)25-22(27)18-7-5-6-8-19(18)23(25)28/h5-12,15,20H,4,13-14H2,1-3H3,(H,24,26)