N-(4-methylphenyl)-2-[[2-(3-methylphenyl)carbonyl-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-methylphenyl)-2-[[2-(3-methylphenyl)carbonyl-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[2-(3-methylbenzoyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(p-tolyl)acetamide CAS Name: N-(4-methylphenyl)-2-[[2-[(3-methylphenyl)-oxomethyl]-5-phenyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[[2-(3-methylbenzoyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methylphenyl)acetamide Traditional Name: 2-[(2-m-toluoyl-5-phenyl-1,2,4-triazol-3-yl)thio]-N-(p-tolyl)acetamide Formula: C25H22N4O2S MolecularWeight: 442.53278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSC2=NC(=NN2C(=O)C3=CC(=CC=C3)C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSC2=NC(=NN2C(=O)C3=CC(=CC=C3)C)C4=CC=CC=C4

InChI

InChI=1S/C25H22N4O2S/c1-17-11-13-21(14-12-17)26-22(30)16-32-25-27-23(19-8-4-3-5-9-19)28-29(25)24(31)20-10-6-7-18(2)15-20/h3-15H,16H2,1-2H3,(H,26,30)