Vitas-M small molecule compound
(4-{(E)-[1-(4-ethoxyphenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-2-methoxyphenoxy)acetic acid
Catalog ID
STK605586
SMILES CCOc1ccc(cc1)N1C(=NC(=O)/C(=C\c2ccc(c(c2)OC)OCC(=O)O)/C1=O)S
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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 C22H20N2O7S MW 456.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O7S/c1-3-30-15-7-5-14(6-8-15)24-21(28)16(20(27)23-22(24)32)10-13-4-9-17(18(11-13)29-2)31-12-19(25)26/h4-11H,3,12H2,1-2H3,(H,25,26)(H,23,27,32)/b16-10+InChIKey
PRRMVKBOOKJVGR-MHWRWJLKSA-NSynonyms
CCOc1ccc(cc1)N1C(=NC(=O)C(=Cc2ccc(c(c2)OC)OCC(=O)O)C1=O)S
MFCD08732505
ZINC000008738119
Check stock
See real-time availability and sample size for STK605586 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.