[2-[2-(2,4-dichlorophenyl)ethylamino]-2-oxidanylidene-ethyl] 2-methylsulfanylpyridine-3-carboxylate

Systemtic Name: [2-[2-(2,4-dichlorophenyl)ethylamino]-2-oxidanylidene-ethyl] 2-methylsulfanylpyridine-3-carboxylate Openeye Name: [2-[2-(2,4-dichlorophenyl)ethylamino]-2-oxo-ethyl] 2-methylsulfanylpyridine-3-carboxylate CAS Name: 2-(methylthio)-3-pyridinecarboxylic acid [2-[2-(2,4-dichlorophenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(2,4-dichlorophenyl)ethylamino]-2-oxoethyl] 2-methylsulfanylpyridine-3-carboxylate Traditional Name: 2-(methylthio)nicotinic acid [2-[2-(2,4-dichlorophenyl)ethylamino]-2-keto-ethyl] ester Formula: C17H16Cl2N2O3S MolecularWeight: 399.29154

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)OCC(=O)NCCC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)OCC(=O)NCCC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C17H16Cl2N2O3S/c1-25-16-13(3-2-7-21-16)17(23)24-10-15(22)20-8-6-11-4-5-12(18)9-14(11)19/h2-5,7,9H,6,8,10H2,1H3,(H,20,22)