2-[2-(4-methylphenyl)sulfanylethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-(4-methylphenyl)sulfanylethyl]isoindole-1,3-dione Openeye Name: 2-[2-(p-tolylsulfanyl)ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[(4-methylphenyl)thio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-(4-methylphenyl)sulfanylethyl]isoindole-1,3-dione Traditional Name: 2-[2-(p-tolylthio)ethyl]isoindoline-1,3-quinone Formula: C17H15NO2S MolecularWeight: 297.3715

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC1=CC=C(C=C1)SCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C17H15NO2S/c1-12-6-8-13(9-7-12)21-11-10-18-16(19)14-4-2-3-5-15(14)17(18)20/h2-9H,10-11H2,1H3