Vitas-M small molecule compound

ethyl 5-cyano-4-(2-fluorophenyl)-6-(methylsulfanyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate

Catalog ID
STK887404
SMILES CCOC(=O)C1C(=O)NC(=C(C1c1ccccc1F)C#N)SC

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C16H15FN2O3S MW 334.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15FN2O3S/c1-3-22-16(21)13-12(9-6-4-5-7-11(9)17)10(8-18)15(23-2)19-14(13)20/h4-7,12-13H,3H2,1-2H3,(H,19,20)
InChIKey
MHZNQBRIUOEGKY-UHFFFAOYSA-N
Synonyms
369394-24-1
369394241
CCOC(=O)C1C(C(=C(NC1=O)SC)C#N)C2=CC=CC=C2F
ethyl5cyano4(2fluorophenyl)6(methylsulfanyl)2oxo1234tetrahydropyridine3carboxylate
ethyl5cyano4(2fluorophenyl)6(methylthio)2oxo1234tetrahydropyridine3carboxylate
ETHYL5CYANO4(2FLUOROPHENYL)6METHYLSULFANYL2OXO34DIHYDRO1HPYRIDINE3CARBOXYLATE
InChI=1SC16H15FN2O3Sc132216(21)1312(9645711(9)17)10(818)15(232)1914(13)20h471213H3H212H3(H1920)
MFCD03000170
ZINC000000302185
ZINC000000302191

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.