Vitas-M small molecule compound
2-chloro-N-(2-{6-[(1E)-3-(2,4-dihydroxy-1-methyl-6-oxo-1,6-dihydropyrimidin-5-yl)-3-oxoprop-1-en-1-yl]-7-methoxy-1,3-benzodioxol-5-yl}ethyl)-N-methylbenzamide
Catalog ID
STK589022
SMILES COc1c(/C=C/C(=O)c2c(O)nc(n(c2=O)C)O)c(CCN(C(=O)c2ccccc2Cl)C)cc2c1OCO2
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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 C26H24ClN3O8 MW 541.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24ClN3O8/c1-29(24(33)16-6-4-5-7-17(16)27)11-10-14-12-19-22(38-13-37-19)21(36-3)15(14)8-9-18(31)20-23(32)28-26(35)30(2)25(20)34/h4-9,12,32H,10-11,13H2,1-3H3,(H,28,35)/b9-8+InChIKey
DGOUWLPBTXBXJC-CMDGGOBGSA-NSynonyms
2chloroN(2(6((1E)3(24dihydroxy1methyl6oxo16dihydropyrimidin5yl)3oxoprop1en1yl)7methoxy13benzodioxol5yl)ethyl)Nmethylbenzamide
COc1c(C=CC(=O)c2c(O)nc(n(c2=O)C)O)c(CCN(C(=O)c2ccccc2Cl)C)cc2c1OCO2
MFCD07794217
ZINC000097968169
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