2-methylsulfanyl-3-phenyl-N-(1H-1,2,4-triazol-5-yl)imidazole-4-carboxamide

Systemtic Name: 2-methylsulfanyl-3-phenyl-N-(1H-1,2,4-triazol-5-yl)imidazole-4-carboxamide Openeye Name: 2-methylsulfanyl-3-phenyl-N-(1H-1,2,4-triazol-5-yl)imidazole-4-carboxamide CAS Name: 2-(methylthio)-3-phenyl-N-(1H-1,2,4-triazol-5-yl)-4-imidazolecarboxamide IUPAC Name: 2-methylsulfanyl-3-phenyl-N-(1H-1,2,4-triazol-5-yl)imidazole-4-carboxamide Traditional Name: 2-(methylthio)-3-phenyl-N-(1H-1,2,4-triazol-5-yl)imidazole-4-carboxamide Formula: C13H12N6OS MolecularWeight: 300.33898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(N1C2=CC=CC=C2)C(=O)NC3=NC=NN3

Isomeric SMILES

CSC1=NC=C(N1C2=CC=CC=C2)C(=O)NC3=NC=NN3

InChI

InChI=1S/C13H12N6OS/c1-21-13-14-7-10(11(20)17-12-15-8-16-18-12)19(13)9-5-3-2-4-6-9/h2-8H,1H3,(H2,15,16,17,18,20)