4-[[4-methyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-3-oxidanylidene-N-phenyl-butanamide

Systemtic Name: 4-[[4-methyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-3-oxidanylidene-N-phenyl-butanamide Openeye Name: 4-[[4-methyl-5-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-3-oxo-N-phenyl-butanamide CAS Name: 4-[[4-methyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]-3-oxo-N-phenylbutanamide IUPAC Name: 4-[[4-methyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-3-oxo-N-phenylbutanamide Traditional Name: 3-keto-4-[[4-methyl-5-(p-tolyl)-1,2,4-triazol-3-yl]thio]-N-phenyl-butyramide Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2C)SCC(=O)CC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2C)SCC(=O)CC(=O)NC3=CC=CC=C3

InChI

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