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

Systemtic Name: 2-[[4-(4-fluorophenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-methyl-ethanamide Openeye Name: 2-[[4-(4-fluorophenyl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-methyl-acetamide CAS Name: 2-[[4-(4-fluorophenyl)-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-N-methylacetamide IUPAC Name: 2-[[4-(4-fluorophenyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-methylacetamide Traditional Name: 2-[[4-(4-fluorophenyl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-N-methyl-acetamide Formula: C16H14FN5OS MolecularWeight: 343.378663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CSC1=NN=C(N1C2=CC=C(C=C2)F)C3=CN=CC=C3

Isomeric SMILES

CNC(=O)CSC1=NN=C(N1C2=CC=C(C=C2)F)C3=CN=CC=C3

InChI

InChI=1S/C16H14FN5OS/c1-18-14(23)10-24-16-21-20-15(11-3-2-8-19-9-11)22(16)13-6-4-12(17)5-7-13/h2-9H,10H2,1H3,(H,18,23)