2-[[5-methyl-4-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1,2-diphenyl-ethanone

Systemtic Name: 2-[[5-methyl-4-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1,2-diphenyl-ethanone Openeye Name: 2-[[5-methyl-4-(m-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-1,2-diphenyl-ethanone CAS Name: 2-[[5-methyl-4-(3-methylphenyl)-1,2,4-triazol-3-yl]thio]-1,2-diphenylethanone IUPAC Name: 2-[[5-methyl-4-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-1,2-diphenylethanone Traditional Name: 2-[[5-methyl-4-(m-tolyl)-1,2,4-triazol-3-yl]thio]-1,2-diphenyl-ethanone Formula: C24H21N3OS MolecularWeight: 399.50804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NN=C2SC(C3=CC=CC=C3)C(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NN=C2SC(C3=CC=CC=C3)C(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C24H21N3OS/c1-17-10-9-15-21(16-17)27-18(2)25-26-24(27)29-23(20-13-7-4-8-14-20)22(28)19-11-5-3-6-12-19/h3-16,23H,1-2H3