Vitas-M small molecule compound
(2-bromo-4-{(E)-[1-(4-ethoxyphenyl)-2-hydroxy-4,6-dioxo-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}phenoxy)acetic acid
Catalog ID
STK627779
SMILES CCOc1ccc(cc1)N1C(=NC(=O)/C(=C\c2ccc(c(c2)Br)OCC(=O)O)/C1=O)O
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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 C21H17BrN2O7 MW 489.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17BrN2O7/c1-2-30-14-6-4-13(5-7-14)24-20(28)15(19(27)23-21(24)29)9-12-3-8-17(16(22)10-12)31-11-18(25)26/h3-10H,2,11H2,1H3,(H,25,26)(H,23,27,29)/b15-9+InChIKey
LKQDVXRDDIDMQU-OQLLNIDSSA-NSynonyms
CCOc1ccc(cc1)N1C(=NC(=O)C(=Cc2ccc(c(c2)Br)OCC(=O)O)C1=O)O
MFCD09788964
ZINC000002279246
Check stock
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Check stock on Vitas-MAvailable files
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