Vitas-M small molecule compound

4-hydroxy-6-methyl-1-(2-{[(4-methyl-1H-imidazol-5-yl)methyl]sulfanyl}ethyl)pyridin-2(1H)-one

Catalog ID
STL509866
SMILES Oc1cc(C)n(c(=O)c1)CCSCc1[nH]cnc1C

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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 C13H17N3O2S MW 279.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17N3O2S/c1-9-5-11(17)6-13(18)16(9)3-4-19-7-12-10(2)14-8-15-12/h5-6,8,17H,3-4,7H2,1-2H3,(H,14,15)
InChIKey
KUQCXKXKSLKQPJ-UHFFFAOYSA-N
Synonyms

134716861
4hydroxy6methyl1(2(((4methyl1Himidazol5yl)methyl)sulfanyl)ethyl)pyridin2(1H)one
4hydroxy6methyl1(2(((5methyl1Himidazol4yl)methyl)thio)ethyl)pyridin2(1H)one
4hydroxy6methyl1(2((5methyl1~(H)imidazol4yl)methylsulfanyl)ethyl)pyridin2one
InChI=1SC13H17N3O2Sc19511(17)613(18)16(9)341971210(2)1481512h56817H347H212H3(H1415)
MFCD31710981
Oc1cc(C)n(c(=O)c1)CCSCc1nc(nH)c1C
ZINC001547200847

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Available files

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