2-(4-methyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-(4-methyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)-N-(4-methylphenyl)ethanamide Openeye Name: 2-(4-methyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)-N-(p-tolyl)acetamide CAS Name: 2-[4-methyl-5-(phenacylthio)-1,2,4-triazol-3-yl]-N-(4-methylphenyl)acetamide IUPAC Name: 2-(4-methyl-5-phenacylsulfanyl-1,2,4-triazol-3-yl)-N-(4-methylphenyl)acetamide Traditional Name: 2-[4-methyl-5-(phenacylthio)-1,2,4-triazol-3-yl]-N-(p-tolyl)acetamide Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CC2=NN=C(N2C)SCC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CC2=NN=C(N2C)SCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H20N4O2S/c1-14-8-10-16(11-9-14)21-19(26)12-18-22-23-20(24(18)2)27-13-17(25)15-6-4-3-5-7-15/h3-11H,12-13H2,1-2H3,(H,21,26)