[2-[2,5-bis(chloranyl)phenyl]-2-oxidanylidene-ethyl] 2-methylsulfanylpyridine-3-carboxylate

Systemtic Name: [2-[2,5-bis(chloranyl)phenyl]-2-oxidanylidene-ethyl] 2-methylsulfanylpyridine-3-carboxylate Openeye Name: [2-(2,5-dichlorophenyl)-2-oxo-ethyl] 2-methylsulfanylpyridine-3-carboxylate CAS Name: 2-(methylthio)-3-pyridinecarboxylic acid [2-(2,5-dichlorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dichlorophenyl)-2-oxoethyl] 2-methylsulfanylpyridine-3-carboxylate Traditional Name: 2-(methylthio)nicotinic acid [2-(2,5-dichlorophenyl)-2-keto-ethyl] ester Formula: C15H11Cl2NO3S MolecularWeight: 356.22374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H11Cl2NO3S/c1-22-14-10(3-2-6-18-14)15(20)21-8-13(19)11-7-9(16)4-5-12(11)17/h2-7H,8H2,1H3