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

Systemtic Name: S-(4-methylphenyl) 2-[1,3-bis(oxidanylidene)isoindol-2-yl]propanethioate Openeye Name: S-(p-tolyl) 2-(1,3-dioxoisoindolin-2-yl)propanethioate CAS Name: 2-(1,3-dioxo-2-isoindolyl)propanethioic acid S-(4-methylphenyl) ester IUPAC Name: S-(4-methylphenyl) 2-(1,3-dioxoisoindol-2-yl)propanethioate Traditional Name: 2-phthalimidopropanethioic acid S-(p-tolyl) ester Formula: C18H15NO3S MolecularWeight: 325.3816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(=O)C(C)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC1=CC=C(C=C1)SC(=O)C(C)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C18H15NO3S/c1-11-7-9-13(10-8-11)23-18(22)12(2)19-16(20)14-5-3-4-6-15(14)17(19)21/h3-10,12H,1-2H3