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

Systemtic Name: N-(4-fluorophenyl)-2-[[4-(2-methylpropyl)-5-phenethyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(4-fluorophenyl)-2-[(4-isobutyl-5-phenethyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(4-fluorophenyl)-2-[[4-(2-methylpropyl)-5-phenethyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(4-fluorophenyl)-2-[[4-(2-methylpropyl)-5-phenethyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(4-fluorophenyl)-2-[(4-isobutyl-5-phenethyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C22H25FN4OS MolecularWeight: 412.523503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)F)CCC3=CC=CC=C3

Isomeric SMILES

CC(C)CN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)F)CCC3=CC=CC=C3

InChI

InChI=1S/C22H25FN4OS/c1-16(2)14-27-20(13-8-17-6-4-3-5-7-17)25-26-22(27)29-15-21(28)24-19-11-9-18(23)10-12-19/h3-7,9-12,16H,8,13-15H2,1-2H3,(H,24,28)