2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]pyridine-3-carboxylic acid

Systemtic Name: 2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]pyridine-3-carboxylic acid Openeye Name: 2-(1-methyltetrazol-5-yl)sulfanylpyridine-3-carboxylic acid CAS Name: 2-[(1-methyl-5-tetrazolyl)thio]-3-pyridinecarboxylic acid IUPAC Name: 2-(1-methyltetrazol-5-yl)sulfanylpyridine-3-carboxylic acid Traditional Name: 2-[(1-methyltetrazol-5-yl)thio]nicotinic acid Formula: C8H7N5O2S MolecularWeight: 237.23848

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SC2=C(C=CC=N2)C(=O)O

Isomeric SMILES

CN1C(=NN=N1)SC2=C(C=CC=N2)C(=O)O

InChI

InChI=1S/C8H7N5O2S/c1-13-8(10-11-12-13)16-6-5(7(14)15)3-2-4-9-6/h2-4H,1H3,(H,14,15)