Vitas-M small molecule compound

ethyl [(3-cyano-4,5,6-trimethylpyridin-2-yl)sulfanyl]acetate

Catalog ID
STK860637
SMILES CCOC(=O)CSc1nc(C)c(c(c1C#N)C)C

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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 C13H16N2O2S MW 264.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16N2O2S/c1-5-17-12(16)7-18-13-11(6-14)9(3)8(2)10(4)15-13/h5,7H2,1-4H3
InChIKey
IRMFWTGCGKYKPT-UHFFFAOYSA-N
Synonyms
313224-35-0
(3CYANO456TRIMETHYLPYRIDIN2YLSULFANYL)ACETICACIDETHYLESTER
313224350
CCOC(=O)CSC1=NC(=C(C(=C1C#N)C)C)C
ethyl((3cyano456trimethylpyridin2yl)sulfanyl)acetate
ethyl2((3cyano456trimethylpyridin2yl)thio)acetate
ETHYL2(3CYANO456TRIMETHYLPYRIDIN2YL)SULFANYLACETATE
InChI=1SC13H16N2O2Sc151712(16)7181311(614)9(3)8(2)10(4)1513h57H214H3
MFCD00569786
ZINC000000301290
ZINC00301290
ZINC301290

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Available files

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