3-methyl-4-(pyridin-2-ylmethylamino)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-methyl-4-(pyridin-2-ylmethylamino)-1H-1,2,4-triazole-5-thione Openeye Name: 3-methyl-4-(2-pyridylmethylamino)-1H-1,2,4-triazole-5-thione CAS Name: 3-methyl-4-(2-pyridinylmethylamino)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-methyl-4-(pyridin-2-ylmethylamino)-1H-1,2,4-triazole-5-thione Traditional Name: 3-methyl-4-(2-pyridylmethylamino)-1H-1,2,4-triazole-5-thione Formula: C9H11N5S MolecularWeight: 221.28214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=S)N1NCC2=CC=CC=N2

Isomeric SMILES

CC1=NNC(=S)N1NCC2=CC=CC=N2

InChI

InChI=1S/C9H11N5S/c1-7-12-13-9(15)14(7)11-6-8-4-2-3-5-10-8/h2-5,11H,6H2,1H3,(H,13,15)