3-propyl-4-(pyridin-3-ylmethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-propyl-4-(pyridin-3-ylmethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-propyl-4-(3-pyridylmethyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-propyl-4-(3-pyridinylmethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-propyl-4-(pyridin-3-ylmethyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-propyl-4-(3-pyridylmethyl)-1H-1,2,4-triazole-5-thione Formula: C11H14N4S MolecularWeight: 234.32066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1CC2=CN=CC=C2

Isomeric SMILES

CCCC1=NNC(=S)N1CC2=CN=CC=C2

InChI

InChI=1S/C11H14N4S/c1-2-4-10-13-14-11(16)15(10)8-9-5-3-6-12-7-9/h3,5-7H,2,4,8H2,1H3,(H,14,16)