2-[2-[cyclopenten-1-yl(methyl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylic acid

Systemtic Name: 2-[2-[cyclopenten-1-yl(methyl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylic acid Openeye Name: 2-[2-[cyclopenten-1-yl(methyl)amino]-2-oxo-ethyl]sulfanylpyridine-3-carboxylic acid CAS Name: 2-[[2-[1-cyclopentenyl(methyl)amino]-2-oxoethyl]thio]-3-pyridinecarboxylic acid IUPAC Name: 2-[2-[cyclopenten-1-yl(methyl)amino]-2-oxoethyl]sulfanylpyridine-3-carboxylic acid Traditional Name: 2-[[2-[cyclopenten-1-yl(methyl)amino]-2-keto-ethyl]thio]nicotinic acid Formula: C14H16N2O3S MolecularWeight: 292.35344

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CCCC1)C(=O)CSC2=C(C=CC=N2)C(=O)O

Isomeric SMILES

CN(C1=CCCC1)C(=O)CSC2=C(C=CC=N2)C(=O)O

InChI

InChI=1S/C14H16N2O3S/c1-16(10-5-2-3-6-10)12(17)9-20-13-11(14(18)19)7-4-8-15-13/h4-5,7-8H,2-3,6,9H2,1H3,(H,18,19)