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

Systemtic Name: N-(4-methylphenyl)-2-[(5-phenyl-2-propanoyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: 2-[(5-phenyl-2-propanoyl-1,2,4-triazol-3-yl)sulfanyl]-N-(p-tolyl)acetamide CAS Name: N-(4-methylphenyl)-2-[[2-(1-oxopropyl)-5-phenyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(4-methylphenyl)-2-[(5-phenyl-2-propanoyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: 2-[(5-phenyl-2-propionyl-1,2,4-triazol-3-yl)thio]-N-(p-tolyl)acetamide Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C(=NC(=N1)C2=CC=CC=C2)SCC(=O)NC3=CC=C(C=C3)C

Isomeric SMILES

CCC(=O)N1C(=NC(=N1)C2=CC=CC=C2)SCC(=O)NC3=CC=C(C=C3)C

InChI

InChI=1S/C20H20N4O2S/c1-3-18(26)24-20(22-19(23-24)15-7-5-4-6-8-15)27-13-17(25)21-16-11-9-14(2)10-12-16/h4-12H,3,13H2,1-2H3,(H,21,25)