3-Ethyl 6-[(carboxymethyl)thio]-5-cyano-1,2-dihydro-2-oxo-3-pyridinecarboxylate

CAS Registry Number®

851175-99-0

CAS Name

3-Ethyl 6-[(carboxymethyl)thio]-5-cyano-1,2-dihydro-2-oxo-3-pyridinecarboxylate

Molecular Formula

C11H10N2O5S

Molecular Mass

282.27

Cite this Page

3-Ethyl 6-[(carboxymethyl)thio]-5-cyano-1,2-dihydro-2-oxo-3-pyridinecarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=851175-99-0 (retrieved 2024-12-19) (CAS RN: 851175-99-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C11H10N2O5S/c1-2-18-11(17)7-3-6(4-12)10(13-9(7)16)19-5-8(14)15/h3H,2,5H2,1H3,(H,13,16)(H,14,15)

InChIKey

InChIKey=KZOBIVWPAVICID-UHFFFAOYSA-N

SMILES

C(OCC)(=O)C1=CC(C#N)=C(SCC(O)=O)NC1=O

Canonical SMILES

N#CC=1C=C(C(=O)OCC)C(=O)NC1SCC(=O)O

Other Names for this Substance

  • 3-Pyridinecarboxylic acid, 6-[(carboxymethyl)thio]-5-cyano-1,2-dihydro-2-oxo-, 3-ethyl ester
  • 3-Ethyl 6-[(carboxymethyl)thio]-5-cyano-1,2-dihydro-2-oxo-3-pyridinecarboxylate
  • 2-[[3-Cyano-5-(ethoxycarbonyl)-6-oxo-1,6-dihydropyridin-2-yl]sulfanyl]acetic acid

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