N-[[5-methylsulfanyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]methyl]-2-pyrazol-1-yl-ethanamide

Systemtic Name: N-[[5-methylsulfanyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]methyl]-2-pyrazol-1-yl-ethanamide Openeye Name: N-[(4-benzyl-5-methylsulfanyl-1,2,4-triazol-3-yl)methyl]-2-pyrazol-1-yl-acetamide CAS Name: N-[[5-(methylthio)-4-(phenylmethyl)-1,2,4-triazol-3-yl]methyl]-2-(1-pyrazolyl)acetamide IUPAC Name: N-[(4-benzyl-5-methylsulfanyl-1,2,4-triazol-3-yl)methyl]-2-pyrazol-1-ylacetamide Traditional Name: N-[[4-benzyl-5-(methylthio)-1,2,4-triazol-3-yl]methyl]-2-pyrazol-1-yl-acetamide Formula: C16H18N6OS MolecularWeight: 342.41872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(N1CC2=CC=CC=C2)CNC(=O)CN3C=CC=N3

Isomeric SMILES

CSC1=NN=C(N1CC2=CC=CC=C2)CNC(=O)CN3C=CC=N3

InChI

InChI=1S/C16H18N6OS/c1-24-16-20-19-14(22(16)11-13-6-3-2-4-7-13)10-17-15(23)12-21-9-5-8-18-21/h2-9H,10-12H2,1H3,(H,17,23)