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

Systemtic Name: N-(2,4-dimethylphenyl)-2-[4-phenyl-3-(phenylmethyl)-5-sulfanylidene-1,2,4-triazol-1-yl]ethanamide Openeye Name: 2-(3-benzyl-4-phenyl-5-thioxo-1,2,4-triazol-1-yl)-N-(2,4-dimethylphenyl)acetamide CAS Name: N-(2,4-dimethylphenyl)-2-[4-phenyl-3-(phenylmethyl)-5-sulfanylidene-1,2,4-triazol-1-yl]acetamide IUPAC Name: 2-(3-benzyl-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)-N-(2,4-dimethylphenyl)acetamide Traditional Name: 2-(3-benzyl-4-phenyl-5-thioxo-1,2,4-triazol-1-yl)-N-(2,4-dimethylphenyl)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)CC3=CC=CC=C3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CN2C(=S)N(C(=N2)CC3=CC=CC=C3)C4=CC=CC=C4)C

InChI

InChI=1S/C25H24N4OS/c1-18-13-14-22(19(2)15-18)26-24(30)17-28-25(31)29(21-11-7-4-8-12-21)23(27-28)16-20-9-5-3-6-10-20/h3-15H,16-17H2,1-2H3,(H,26,30)