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

Systemtic Name: 2-[2-[1-(3-methylphenyl)imidazol-2-yl]sulfanylethyl]isoindole-1,3-dione Openeye Name: 2-[2-[1-(m-tolyl)imidazol-2-yl]sulfanylethyl]isoindoline-1,3-dione CAS Name: 2-[2-[[1-(3-methylphenyl)-2-imidazolyl]thio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[1-(3-methylphenyl)imidazol-2-yl]sulfanylethyl]isoindole-1,3-dione Traditional Name: 2-[2-[[1-(m-tolyl)imidazol-2-yl]thio]ethyl]isoindoline-1,3-quinone Formula: C20H17N3O2S MolecularWeight: 363.43288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C=CN=C2SCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=CC(=CC=C1)N2C=CN=C2SCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C20H17N3O2S/c1-14-5-4-6-15(13-14)22-10-9-21-20(22)26-12-11-23-18(24)16-7-2-3-8-17(16)19(23)25/h2-10,13H,11-12H2,1H3