Vitas-M small molecule compound

2-{[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl}-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile

Catalog ID
STK746502
SMILES COCc1cc(C)nc(c1C#N)SCC(=O)c1ccc(cc1C)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 C19H20N2O2S MW 340.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N2O2S/c1-12-5-6-16(13(2)7-12)18(22)11-24-19-17(9-20)15(10-23-4)8-14(3)21-19/h5-8H,10-11H2,1-4H3
InChIKey
FJJWPUDCNHYCEE-UHFFFAOYSA-N
Synonyms

2((2(24dimethylphenyl)2oxoethyl)sulfanyl)4(methoxymethyl)6methylpyridine3carbonitrile
2(2(24DIMETHYLPHENYL)2OXOETHYL)SULFANYL4(METHOXYMETHYL)6METHYLPYRIDINE3CARBONITRILE
CC1=CC(=C(C=C1)C(=O)CSC2=C(C(=CC(=N2)C)COC)C#N)C
InChI=1SC19H20N2O2Sc1125616(13(2)712)18(22)11241917(920)15(10234)814(3)2119h58H1011H214H3
MFCD00741459
ZINC000000049762
ZINC00049762
ZINC49762

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Available files

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