[2-oxidanylidene-2-[(2-prop-2-enylsulfanylphenyl)amino]ethyl] 2-ethoxypyridine-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(2-prop-2-enylsulfanylphenyl)amino]ethyl] 2-ethoxypyridine-3-carboxylate Openeye Name: [2-(2-allylsulfanylanilino)-2-oxo-ethyl] 2-ethoxypyridine-3-carboxylate CAS Name: 2-ethoxy-3-pyridinecarboxylic acid [2-oxo-2-[2-(prop-2-enylthio)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(2-prop-2-enylsulfanylanilino)ethyl] 2-ethoxypyridine-3-carboxylate Traditional Name: 2-ethoxynicotinic acid [2-[2-(allylthio)anilino]-2-keto-ethyl] ester Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=N1)C(=O)OCC(=O)NC2=CC=CC=C2SCC=C

Isomeric SMILES

CCOC1=C(C=CC=N1)C(=O)OCC(=O)NC2=CC=CC=C2SCC=C

InChI

InChI=1S/C19H20N2O4S/c1-3-12-26-16-10-6-5-9-15(16)21-17(22)13-25-19(23)14-8-7-11-20-18(14)24-4-2/h3,5-11H,1,4,12-13H2,2H3,(H,21,22)