1-(3-methylphenyl)-3-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]pyrrolidine-2,5-dione

Systemtic Name: 1-(3-methylphenyl)-3-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]pyrrolidine-2,5-dione Openeye Name: 1-(m-tolyl)-3-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]pyrrolidine-2,5-dione CAS Name: 1-(3-methylphenyl)-3-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]pyrrolidine-2,5-dione IUPAC Name: 1-(3-methylphenyl)-3-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]pyrrolidine-2,5-dione Traditional Name: 1-(m-tolyl)-3-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]pyrrolidine-2,5-quinone Formula: C19H16N4O2S MolecularWeight: 364.42094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)CC(C2=O)SC3=NNC(=N3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)CC(C2=O)SC3=NNC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C19H16N4O2S/c1-12-6-5-9-14(10-12)23-16(24)11-15(18(23)25)26-19-20-17(21-22-19)13-7-3-2-4-8-13/h2-10,15H,11H2,1H3,(H,20,21,22)