Vitas-M small molecule compound
methyl 3-(4-bromo-2-fluorophenyl)-3-{2-hydroxy-1-[2-(1H-imidazol-4-yl)ethyl]-6-methyl-4-oxo-1,4-dihydropyridin-3-yl}propanoate
Catalog ID
STL567488
SMILES COC(=O)CC(c1c(=O)cc(n(c1O)CCc1c[nH]cn1)C)c1ccc(cc1F)Br
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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 C21H21BrFN3O4 MW 478.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21BrFN3O4/c1-12-7-18(27)20(21(29)26(12)6-5-14-10-24-11-25-14)16(9-19(28)30-2)15-4-3-13(22)8-17(15)23/h3-4,7-8,10-11,16,29H,5-6,9H2,1-2H3,(H,24,25)InChIKey
OAJDTBQTHAPPOT-UHFFFAOYSA-NSynonyms
methyl3(4bromo2fluorophenyl)3(2hydroxy1(2(1Himidazol4yl)ethyl)6methyl4oxo14dihydropyridin3yl)propanoate
MFCD32652698
ZINC000888089201
ZINC000888089202
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