5-propyl-3-sulfanyl-pyridine-2-carboxylic acid

Systemtic Name: 5-propyl-3-sulfanyl-pyridine-2-carboxylic acid Openeye Name: 5-propyl-3-sulfanyl-pyridine-2-carboxylic acid CAS Name: 3-mercapto-5-propyl-2-pyridinecarboxylic acid IUPAC Name: 5-propyl-3-sulfanylpyridine-2-carboxylic acid Traditional Name: 3-mercapto-5-propyl-picolinic acid Formula: C9H11NO2S MolecularWeight: 197.25414

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(N=C1)C(=O)O)S

Isomeric SMILES

CCCC1=CC(=C(N=C1)C(=O)O)S

InChI

InChI=1S/C9H11NO2S/c1-2-3-6-4-7(13)8(9(11)12)10-5-6/h4-5,13H,2-3H2,1H3,(H,11,12)