Vitas-M small molecule compound

tert-butyl [(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]acetate

Catalog ID
STK748030
SMILES N#Cc1cc(C(=O)C)c(nc1SCC(=O)OC(C)(C)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 C15H18N2O3S MW 306.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18N2O3S/c1-9-12(10(2)18)6-11(7-16)14(17-9)21-8-13(19)20-15(3,4)5/h6H,8H2,1-5H3
InChIKey
RBYBAYRGEKJMIW-UHFFFAOYSA-N
Synonyms

CC1=C(C=C(C(=N1)SCC(=O)OC(C)(C)C)C#N)C(=O)C
InChI=1SC15H18N2O3Sc1912(10(2)18)611(716)14(179)21813(19)2015(34)5h6H8H215H3
MFCD00742748
tertbutyl((5acetyl3cyano6methylpyridin2yl)sulfanyl)acetate
TERTBUTYL((5ACETYL3CYANO6METHYLPYRIDIN2YL)THIO)ACETATE
TERTBUTYL2(5ACETYL3CYANO6METHYL2PYRIDYLTHIO)ACETATE
TERTBUTYL2(5ACETYL3CYANO6METHYLPYRIDIN2YL)SULFANYLACETATE
ZINC000000139461
ZINC00139461
ZINC139461

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Available files

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