6-[2-[(3-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylic acid

Systemtic Name: 6-[2-[(3-ethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanylpyridine-3-carboxylic acid Openeye Name: 6-[2-(3-ethoxyanilino)-2-oxo-ethyl]sulfanylpyridine-3-carboxylic acid CAS Name: 6-[[2-(3-ethoxyanilino)-2-oxoethyl]thio]-3-pyridinecarboxylic acid IUPAC Name: 6-[2-(3-ethoxyanilino)-2-oxoethyl]sulfanylpyridine-3-carboxylic acid Traditional Name: 6-[[2-keto-2-(m-phenetidino)ethyl]thio]nicotinic acid Formula: C16H16N2O4S MolecularWeight: 332.37424

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)NC(=O)CSC2=NC=C(C=C2)C(=O)O

Isomeric SMILES

CCOC1=CC=CC(=C1)NC(=O)CSC2=NC=C(C=C2)C(=O)O

InChI

InChI=1S/C16H16N2O4S/c1-2-22-13-5-3-4-12(8-13)18-14(19)10-23-15-7-6-11(9-17-15)16(20)21/h3-9H,2,10H2,1H3,(H,18,19)(H,20,21)