1-(2-pyridin-2-ylsulfanylethyl)-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 1-(2-pyridin-2-ylsulfanylethyl)-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-[2-(2-pyridylsulfanyl)ethyl]triazole-4-carboxylic acid CAS Name: 1-[2-(2-pyridinylthio)ethyl]-4-triazolecarboxylic acid IUPAC Name: 1-(2-pyridin-2-ylsulfanylethyl)triazole-4-carboxylic acid Traditional Name: 1-[2-(2-pyridylthio)ethyl]triazole-4-carboxylic acid Formula: C10H10N4O2S MolecularWeight: 250.277

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)SCCN2C=C(N=N2)C(=O)O

Isomeric SMILES

C1=CC=NC(=C1)SCCN2C=C(N=N2)C(=O)O

InChI

InChI=1S/C10H10N4O2S/c15-10(16)8-7-14(13-12-8)5-6-17-9-3-1-2-4-11-9/h1-4,7H,5-6H2,(H,15,16)