3,6-bis(ethylsulfanyl)pyridine-2-carboxylic acid

Systemtic Name: 3,6-bis(ethylsulfanyl)pyridine-2-carboxylic acid Openeye Name: 3,6-bis(ethylsulfanyl)pyridine-2-carboxylic acid CAS Name: 3,6-bis(ethylthio)-2-pyridinecarboxylic acid IUPAC Name: 3,6-bis(ethylsulfanyl)pyridine-2-carboxylic acid Traditional Name: 3,6-bis(ethylthio)picolinic acid Formula: C10H13NO2S2 MolecularWeight: 243.34572

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(N=C(C=C1)SCC)C(=O)O

Isomeric SMILES

CCSC1=C(N=C(C=C1)SCC)C(=O)O

InChI

InChI=1S/C10H13NO2S2/c1-3-14-7-5-6-8(15-4-2)11-9(7)10(12)13/h5-6H,3-4H2,1-2H3,(H,12,13)