N-[1,3-bis(oxidanylidene)isoindol-4-yl]-4-(4-methylphenyl)sulfanyl-butanamide

Systemtic Name: N-[1,3-bis(oxidanylidene)isoindol-4-yl]-4-(4-methylphenyl)sulfanyl-butanamide Openeye Name: N-(1,3-dioxoisoindolin-4-yl)-4-(p-tolylsulfanyl)butanamide CAS Name: N-(1,3-dioxo-4-isoindolyl)-4-[(4-methylphenyl)thio]butanamide IUPAC Name: N-(1,3-dioxoisoindol-4-yl)-4-(4-methylphenyl)sulfanylbutanamide Traditional Name: N-(1,3-diketoisoindolin-4-yl)-4-(p-tolylthio)butyramide Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCCC(=O)NC2=CC=CC3=C2C(=O)NC3=O

Isomeric SMILES

CC1=CC=C(C=C1)SCCCC(=O)NC2=CC=CC3=C2C(=O)NC3=O

InChI

InChI=1S/C19H18N2O3S/c1-12-7-9-13(10-8-12)25-11-3-6-16(22)20-15-5-2-4-14-17(15)19(24)21-18(14)23/h2,4-5,7-10H,3,6,11H2,1H3,(H,20,22)(H,21,23,24)