2-(5-methylpyridin-2-yl)sulfanylpyridine-3-carboxylic acid

Systemtic Name: 2-(5-methylpyridin-2-yl)sulfanylpyridine-3-carboxylic acid Openeye Name: 2-[(5-methyl-2-pyridyl)sulfanyl]pyridine-3-carboxylic acid CAS Name: 2-[(5-methyl-2-pyridinyl)thio]-3-pyridinecarboxylic acid IUPAC Name: 2-(5-methylpyridin-2-yl)sulfanylpyridine-3-carboxylic acid Traditional Name: 2-[(5-methyl-2-pyridyl)thio]nicotinic acid Formula: C12H10N2O2S MolecularWeight: 246.285

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)SC2=C(C=CC=N2)C(=O)O

Isomeric SMILES

CC1=CN=C(C=C1)SC2=C(C=CC=N2)C(=O)O

InChI

InChI=1S/C12H10N2O2S/c1-8-4-5-10(14-7-8)17-11-9(12(15)16)3-2-6-13-11/h2-7H,1H3,(H,15,16)