2-butan-2-ylsulfanyl-6-chloranyl-pyridine-4-carboxylic acid

Systemtic Name: 2-butan-2-ylsulfanyl-6-chloranyl-pyridine-4-carboxylic acid Openeye Name: 2-chloro-6-sec-butylsulfanyl-pyridine-4-carboxylic acid CAS Name: 2-(butan-2-ylthio)-6-chloro-4-pyridinecarboxylic acid IUPAC Name: 2-butan-2-ylsulfanyl-6-chloropyridine-4-carboxylic acid Traditional Name: 2-chloro-6-(sec-butylthio)isonicotinic acid Formula: C10H12ClNO2S MolecularWeight: 245.72578

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=NC(=CC(=C1)C(=O)O)Cl

Isomeric SMILES

CCC(C)SC1=NC(=CC(=C1)C(=O)O)Cl

InChI

InChI=1S/C10H12ClNO2S/c1-3-6(2)15-9-5-7(10(13)14)4-8(11)12-9/h4-6H,3H2,1-2H3,(H,13,14)