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

Systemtic Name: 2-[2-[ethyl(methyl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylic acid Openeye Name: 2-[2-[ethyl(methyl)amino]-2-oxo-ethyl]sulfanylpyridine-3-carboxylic acid CAS Name: 2-[[2-[ethyl(methyl)amino]-2-oxoethyl]thio]-3-pyridinecarboxylic acid IUPAC Name: 2-[2-[ethyl(methyl)amino]-2-oxoethyl]sulfanylpyridine-3-carboxylic acid Traditional Name: 2-[[2-[ethyl(methyl)amino]-2-keto-ethyl]thio]nicotinic acid Formula: C11H14N2O3S MolecularWeight: 254.30546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N2O3S/c1-3-13(2)9(14)7-17-10-8(11(15)16)5-4-6-12-10/h4-6H,3,7H2,1-2H3,(H,15,16)