5-methyl-N-(2-methylsulfanylphenyl)-2-phenyl-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-methyl-N-(2-methylsulfanylphenyl)-2-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: 5-methyl-N-(2-methylsulfanylphenyl)-2-phenyl-triazole-4-carboxamide CAS Name: 5-methyl-N-[2-(methylthio)phenyl]-2-phenyl-4-triazolecarboxamide IUPAC Name: 5-methyl-N-(2-methylsulfanylphenyl)-2-phenyltriazole-4-carboxamide Traditional Name: 5-methyl-N-[2-(methylthio)phenyl]-2-phenyl-triazole-4-carboxamide Formula: C17H16N4OS MolecularWeight: 324.40014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(N=C1C(=O)NC2=CC=CC=C2SC)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(N=C1C(=O)NC2=CC=CC=C2SC)C3=CC=CC=C3

InChI

InChI=1S/C17H16N4OS/c1-12-16(20-21(19-12)13-8-4-3-5-9-13)17(22)18-14-10-6-7-11-15(14)23-2/h3-11H,1-2H3,(H,18,22)