6-tert-butyl-2-sulfanylidene-1H-pyridine-3-carboxylic acid

Systemtic Name: 6-tert-butyl-2-sulfanylidene-1H-pyridine-3-carboxylic acid Openeye Name: 6-tert-butyl-2-thioxo-1H-pyridine-3-carboxylic acid CAS Name: 6-tert-butyl-2-sulfanylidene-1H-pyridine-3-carboxylic acid IUPAC Name: 6-tert-butyl-2-sulfanylidene-1H-pyridine-3-carboxylic acid Traditional Name: 6-tert-butyl-2-thioxo-1H-pyridine-3-carboxylic acid Formula: C10H13NO2S MolecularWeight: 211.28072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C(=S)N1)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C(=S)N1)C(=O)O

InChI

InChI=1S/C10H13NO2S/c1-10(2,3)7-5-4-6(9(12)13)8(14)11-7/h4-5H,1-3H3,(H,11,14)(H,12,13)