6-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]pyridine-3-carboxylic acid

Systemtic Name: 6-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]pyridine-3-carboxylic acid Openeye Name: 6-(1-methyltetrazol-5-yl)sulfanylpyridine-3-carboxylic acid CAS Name: 6-[(1-methyl-5-tetrazolyl)thio]-3-pyridinecarboxylic acid IUPAC Name: 6-(1-methyltetrazol-5-yl)sulfanylpyridine-3-carboxylic acid Traditional Name: 6-[(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=NC=C(C=C2)C(=O)O

Isomeric SMILES

CN1C(=NN=N1)SC2=NC=C(C=C2)C(=O)O

InChI

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