2-butylsulfanyl-6-chloranyl-pyridine-4-carboxylic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC(=CC(=C1)C(=O)O)Cl

Isomeric SMILES

CCCCSC1=NC(=CC(=C1)C(=O)O)Cl

InChI

InChI=1S/C10H12ClNO2S/c1-2-3-4-15-9-6-7(10(13)14)5-8(11)12-9/h5-6H,2-4H2,1H3,(H,13,14)