Vitas-M small molecule compound
3-[(4-{(E)-[1-(4-ethoxyphenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}phenoxy)methyl]benzoic acid
Catalog ID
STK617575
SMILES CCOc1ccc(cc1)N1C(=NC(=O)/C(=C\c2ccc(cc2)OCc2cccc(c2)C(=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 C27H22N2O6S MW 502.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O6S/c1-2-34-21-12-8-20(9-13-21)29-25(31)23(24(30)28-27(29)36)15-17-6-10-22(11-7-17)35-16-18-4-3-5-19(14-18)26(32)33/h3-15H,2,16H2,1H3,(H,32,33)(H,28,30,36)/b23-15+InChIKey
VMFXAYLPGHHRPG-HZHRSRAPSA-NSynonyms
CCOc1ccc(cc1)N1C(=NC(=O)C(=Cc2ccc(cc2)OCc2cccc(c2)C(=O)O)C1=O)S
MFCD09797896
ZINC000002308579
Check stock
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Check stock on Vitas-MAvailable files
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