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

Systemtic Name: 2-[[4-(2-methylpropyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[(4-isobutyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: 2-[[4-(2-methylpropyl)-5-phenyl-1,2,4-triazol-3-yl]thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[[4-(2-methylpropyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-benzyl-2-[(4-isobutyl-5-phenyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C21H24N4OS MolecularWeight: 380.50646

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NN=C1SCC(=O)NCC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)CN1C(=NN=C1SCC(=O)NCC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H24N4OS/c1-16(2)14-25-20(18-11-7-4-8-12-18)23-24-21(25)27-15-19(26)22-13-17-9-5-3-6-10-17/h3-12,16H,13-15H2,1-2H3,(H,22,26)