S-(4-methylphenyl) 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanethioate

Systemtic Name: S-(4-methylphenyl) 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butanethioate Openeye Name: S-(p-tolyl) 4-(1,3-dioxoisoindolin-2-yl)butanethioate CAS Name: 4-(1,3-dioxo-2-isoindolyl)butanethioic acid S-(4-methylphenyl) ester IUPAC Name: S-(4-methylphenyl) 4-(1,3-dioxoisoindol-2-yl)butanethioate Traditional Name: 4-phthalimidobutanethioic acid S-(p-tolyl) ester Formula: C19H17NO3S MolecularWeight: 339.40818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC1=CC=C(C=C1)SC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C19H17NO3S/c1-13-8-10-14(11-9-13)24-17(21)7-4-12-20-18(22)15-5-2-3-6-16(15)19(20)23/h2-3,5-6,8-11H,4,7,12H2,1H3