Vitas-M small molecule compound

methyl 5-cyano-6-(methylsulfanyl)-2-oxo-4-phenyl-1,2,3,4-tetrahydropyridine-3-carboxylate

Catalog ID
STK538645
SMILES COC(=O)C1C(=O)NC(=C(C1c1ccccc1)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 C15H14N2O3S MW 302.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14N2O3S/c1-20-15(19)12-11(9-6-4-3-5-7-9)10(8-16)14(21-2)17-13(12)18/h3-7,11-12H,1-2H3,(H,17,18)
InChIKey
ZIARVQKRSMDQFD-UHFFFAOYSA-N
Synonyms
383895-28-1
383895281
COC(=O)C1C(C(=C(NC1=O)SC)C#N)C2=CC=CC=C2
InChI=1SC15H14N2O3Sc12015(19)1211(9643579)10(816)14(212)1713(12)18h371112H12H3(H1718)
methyl5cyano6(methylsulfanyl)2oxo4phenyl1234tetrahydropyridine3carboxylate
methyl5cyano6(methylthio)2oxo4phenyl1234tetrahydropyridine3carboxylate
METHYL5CYANO6METHYLSULFANYL2OXO4PHENYL34DIHYDRO1HPYRIDINE3CARBOXYLATE
MFCD03000714
ZINC000008994832
ZINC000008996118

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Available files

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