2-propan-2-ylsulfanylpyridine-3-carboxylic acid

Systemtic Name: 2-propan-2-ylsulfanylpyridine-3-carboxylic acid Openeye Name: 2-isopropylsulfanylpyridine-3-carboxylic acid CAS Name: 2-(propan-2-ylthio)-3-pyridinecarboxylic acid IUPAC Name: 2-propan-2-ylsulfanylpyridine-3-carboxylic acid Traditional Name: 2-(isopropylthio)nicotinic acid Formula: C9H11NO2S MolecularWeight: 197.25414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=C(C=CC=N1)C(=O)O

Isomeric SMILES

CC(C)SC1=C(C=CC=N1)C(=O)O

InChI

InChI=1S/C9H11NO2S/c1-6(2)13-8-7(9(11)12)4-3-5-10-8/h3-6H,1-2H3,(H,11,12)