5-(4-methylsulfanylphenyl)-2-oxidanylidene-1H-pyridine-3-carboxylic acid

Systemtic Name: 5-(4-methylsulfanylphenyl)-2-oxidanylidene-1H-pyridine-3-carboxylic acid Openeye Name: 5-(4-methylsulfanylphenyl)-2-oxo-1H-pyridine-3-carboxylic acid CAS Name: 5-[4-(methylthio)phenyl]-2-oxo-1H-pyridine-3-carboxylic acid IUPAC Name: 5-(4-methylsulfanylphenyl)-2-oxo-1H-pyridine-3-carboxylic acid Traditional Name: 2-keto-5-[4-(methylthio)phenyl]-1H-pyridine-3-carboxylic acid Formula: C13H11NO3S MolecularWeight: 261.29634

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=CNC(=O)C(=C2)C(=O)O

Isomeric SMILES

CSC1=CC=C(C=C1)C2=CNC(=O)C(=C2)C(=O)O

InChI

InChI=1S/C13H11NO3S/c1-18-10-4-2-8(3-5-10)9-6-11(13(16)17)12(15)14-7-9/h2-7H,1H3,(H,14,15)(H,16,17)