1-methyl-4-pyridin-2-yl-1,2,4-triazolidin-4-ium-3-thiolate

Systemtic Name: 1-methyl-4-pyridin-2-yl-1,2,4-triazolidin-4-ium-3-thiolate Openeye Name: 1-methyl-4-(2-pyridyl)-1,2,4-triazolidin-4-ium-3-thiolate CAS Name: 1-methyl-4-(2-pyridinyl)-1,2,4-triazolidin-4-ium-3-thiolate IUPAC Name: 1-methyl-4-pyridin-2-yl-1,2,4-triazolidin-4-ium-3-thiolate Traditional Name: 1-methyl-4-(2-pyridyl)-1,2,4-triazolidin-4-ium-3-thiolate Formula: C8H12N4S MolecularWeight: 196.27268

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Descriptors Computed from Structure

Canonical SMILES:

CN1C[NH+](C(N1)[S-])C2=CC=CC=N2

Isomeric SMILES

CN1C[NH+](C(N1)[S-])C2=CC=CC=N2

InChI

InChI=1S/C8H12N4S/c1-11-6-12(8(13)10-11)7-4-2-3-5-9-7/h2-5,8,10,13H,6H2,1H3