[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 5,6-bis(chloranyl)pyridine-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 5,6-bis(chloranyl)pyridine-3-carboxylate Openeye Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 5,6-dichloropyridine-3-carboxylate CAS Name: 5,6-dichloro-3-pyridinecarboxylic acid [2-oxo-2-[2-(phenylthio)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 5,6-dichloropyridine-3-carboxylate Traditional Name: 5,6-dichloronicotinic acid [2-keto-2-[2-(phenylthio)ethylamino]ethyl] ester Formula: C16H14Cl2N2O3S MolecularWeight: 385.26496

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCNC(=O)COC(=O)C2=CC(=C(N=C2)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)SCCNC(=O)COC(=O)C2=CC(=C(N=C2)Cl)Cl

InChI

InChI=1S/C16H14Cl2N2O3S/c17-13-8-11(9-20-15(13)18)16(22)23-10-14(21)19-6-7-24-12-4-2-1-3-5-12/h1-5,8-9H,6-7,10H2,(H,19,21)