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

Systemtic Name: 2-[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl]sulfanylpyridine-3-carboxylic acid Openeye Name: 2-[2-oxo-2-[2-(2-thienyl)ethylamino]ethyl]sulfanylpyridine-3-carboxylic acid CAS Name: 2-[[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]thio]-3-pyridinecarboxylic acid IUPAC Name: 2-[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]sulfanylpyridine-3-carboxylic acid Traditional Name: 2-[[2-keto-2-[2-(2-thienyl)ethylamino]ethyl]thio]nicotinic acid Formula: C14H14N2O3S2 MolecularWeight: 322.40256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SCC(=O)NCCC2=CC=CS2)C(=O)O

Isomeric SMILES

C1=CC(=C(N=C1)SCC(=O)NCCC2=CC=CS2)C(=O)O

InChI

InChI=1S/C14H14N2O3S2/c17-12(15-7-5-10-3-2-8-20-10)9-21-13-11(14(18)19)4-1-6-16-13/h1-4,6,8H,5,7,9H2,(H,15,17)(H,18,19)