4-methyl-5-phenyl-1-sulfanyl-1,2,3-triazole

Systemtic Name: 4-methyl-5-phenyl-1-sulfanyl-1,2,3-triazole Openeye Name: 4-methyl-5-phenyl-1-sulfanyl-triazole CAS Name: 1-mercapto-4-methyl-5-phenyltriazole IUPAC Name: 4-methyl-5-phenyl-1-sulfanyltriazole Traditional Name: 1-mercapto-4-methyl-5-phenyl-triazole Formula: C9H9N3S MolecularWeight: 191.25286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=N1)S)C2=CC=CC=C2

Isomeric SMILES

CC1=C(N(N=N1)S)C2=CC=CC=C2

InChI

InChI=1S/C9H9N3S/c1-7-9(12(13)11-10-7)8-5-3-2-4-6-8/h2-6,13H,1H3