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

Systemtic Name: 2-[4-(2,5-dimethylphenyl)-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]-N-(4-methylphenyl)ethanamide Openeye Name: 2-[4-(2,5-dimethylphenyl)-3-phenyl-5-thioxo-1,2,4-triazol-1-yl]-N-(p-tolyl)acetamide CAS Name: 2-[4-(2,5-dimethylphenyl)-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[4-(2,5-dimethylphenyl)-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]-N-(4-methylphenyl)acetamide Traditional Name: 2-[4-(2,5-dimethylphenyl)-3-phenyl-5-thioxo-1,2,4-triazol-1-yl]-N-(p-tolyl)acetamide Formula: C25H24N4OS MolecularWeight: 428.54926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CN2C(=S)N(C(=N2)C3=CC=CC=C3)C4=C(C=CC(=C4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN2C(=S)N(C(=N2)C3=CC=CC=C3)C4=C(C=CC(=C4)C)C

InChI

InChI=1S/C25H24N4OS/c1-17-10-13-21(14-11-17)26-23(30)16-28-25(31)29(22-15-18(2)9-12-19(22)3)24(27-28)20-7-5-4-6-8-20/h4-15H,16H2,1-3H3,(H,26,30)