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

Systemtic Name: [2-[(2,4-dichlorophenyl)methylamino]-2-oxidanylidene-ethyl] 2-methylsulfanylpyridine-3-carboxylate Openeye Name: [2-[(2,4-dichlorophenyl)methylamino]-2-oxo-ethyl] 2-methylsulfanylpyridine-3-carboxylate CAS Name: 2-(methylthio)-3-pyridinecarboxylic acid [2-[(2,4-dichlorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(2,4-dichlorophenyl)methylamino]-2-oxoethyl] 2-methylsulfanylpyridine-3-carboxylate Traditional Name: 2-(methylthio)nicotinic acid [2-[(2,4-dichlorobenzyl)amino]-2-keto-ethyl] ester Formula: C16H14Cl2N2O3S MolecularWeight: 385.26496

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)OCC(=O)NCC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)OCC(=O)NCC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C16H14Cl2N2O3S/c1-24-15-12(3-2-6-19-15)16(22)23-9-14(21)20-8-10-4-5-11(17)7-13(10)18/h2-7H,8-9H2,1H3,(H,20,21)