4-butyl-5-pyridin-4-yl-1,2,4-triazole-3-thiolate

Systemtic Name: 4-butyl-5-pyridin-4-yl-1,2,4-triazole-3-thiolate Openeye Name: 4-butyl-5-(4-pyridyl)-1,2,4-triazole-3-thiolate CAS Name: 4-butyl-5-pyridin-4-yl-1,2,4-triazole-3-thiolate IUPAC Name: 4-butyl-5-pyridin-4-yl-1,2,4-triazole-3-thiolate Traditional Name: 4-butyl-5-(4-pyridyl)-1,2,4-triazole-3-thiolate Formula: C11H13N4S- MolecularWeight: 233.31272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=C1[S-])C2=CC=NC=C2

Isomeric SMILES

CCCCN1C(=NN=C1[S-])C2=CC=NC=C2

InChI

InChI=1S/C11H14N4S/c1-2-3-8-15-10(13-14-11(15)16)9-4-6-12-7-5-9/h4-7H,2-3,8H2,1H3,(H,14,16)/p-1