1-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]-1,2,3-triazole-4-carboxylate

Systemtic Name: 1-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]-1,2,3-triazole-4-carboxylate Openeye Name: 1-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]triazole-4-carboxylate CAS Name: 1-[2-[(4-methyl-1,2,4-triazol-3-yl)thio]ethyl]-4-triazolecarboxylate IUPAC Name: 1-[2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethyl]triazole-4-carboxylate Traditional Name: 1-[2-[(4-methyl-1,2,4-triazol-3-yl)thio]ethyl]triazole-4-carboxylate Formula: C8H9N6O2S- MolecularWeight: 253.26106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCCN2C=C(N=N2)C(=O)[O-]

Isomeric SMILES

CN1C=NN=C1SCCN2C=C(N=N2)C(=O)[O-]

InChI

InChI=1S/C8H10N6O2S/c1-13-5-9-11-8(13)17-3-2-14-4-6(7(15)16)10-12-14/h4-5H,2-3H2,1H3,(H,15,16)/p-1