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

Systemtic Name: 2-[[4-(2-methylpropyl)-5-phenethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[(4-isobutyl-5-phenethyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: 2-[[4-(2-methylpropyl)-5-phenethyl-1,2,4-triazol-3-yl]thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[[4-(2-methylpropyl)-5-phenethyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-benzyl-2-[(4-isobutyl-5-phenethyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C23H28N4OS MolecularWeight: 408.55962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NN=C1SCC(=O)NCC2=CC=CC=C2)CCC3=CC=CC=C3

Isomeric SMILES

CC(C)CN1C(=NN=C1SCC(=O)NCC2=CC=CC=C2)CCC3=CC=CC=C3

InChI

InChI=1S/C23H28N4OS/c1-18(2)16-27-21(14-13-19-9-5-3-6-10-19)25-26-23(27)29-17-22(28)24-15-20-11-7-4-8-12-20/h3-12,18H,13-17H2,1-2H3,(H,24,28)