2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylic acid

Systemtic Name: 2-[2-(dimethylamino)-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylic acid Openeye Name: 2-[2-(dimethylamino)-2-oxo-ethyl]sulfanylpyridine-3-carboxylic acid CAS Name: 2-[[2-(dimethylamino)-2-oxoethyl]thio]-3-pyridinecarboxylic acid IUPAC Name: 2-[2-(dimethylamino)-2-oxoethyl]sulfanylpyridine-3-carboxylic acid Traditional Name: 2-[[2-(dimethylamino)-2-keto-ethyl]thio]nicotinic acid Formula: C10H12N2O3S MolecularWeight: 240.27888

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CSC1=C(C=CC=N1)C(=O)O

Isomeric SMILES

CN(C)C(=O)CSC1=C(C=CC=N1)C(=O)O

InChI

InChI=1S/C10H12N2O3S/c1-12(2)8(13)6-16-9-7(10(14)15)4-3-5-11-9/h3-5H,6H2,1-2H3,(H,14,15)