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

Systemtic Name: S-(4-methylphenyl) 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethanethioate Openeye Name: S-(p-tolyl) 2-(1,3-dioxoisoindolin-2-yl)ethanethioate CAS Name: 2-(1,3-dioxo-2-isoindolyl)ethanethioic acid S-(4-methylphenyl) ester IUPAC Name: S-(4-methylphenyl) 2-(1,3-dioxoisoindol-2-yl)ethanethioate Traditional Name: 2-phthalimidoethanethioic acid S-(p-tolyl) ester Formula: C17H13NO3S MolecularWeight: 311.35502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(=O)CN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC1=CC=C(C=C1)SC(=O)CN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C17H13NO3S/c1-11-6-8-12(9-7-11)22-15(19)10-18-16(20)13-4-2-3-5-14(13)17(18)21/h2-9H,10H2,1H3