Vitas-M small molecule compound
(4E)-4-{4-[(2-chloro-6-fluorobenzyl)oxy]-3-ethoxybenzylidene}-5-hydroxy-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL407065
SMILES CCOc1cc(ccc1OCc1c(F)cccc1Cl)/C=C/1\C(=NN(C1=O)c1ccccc1)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 C25H20ClFN2O4 MW 466.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20ClFN2O4/c1-2-32-23-14-16(11-12-22(23)33-15-19-20(26)9-6-10-21(19)27)13-18-24(30)28-29(25(18)31)17-7-4-3-5-8-17/h3-14H,2,15H2,1H3,(H,28,30)/b18-13+InChIKey
ZJXJXFWYXJFVBU-QGOAFFKASA-NSynonyms
(4E)4(4((2chloro6fluorobenzyl)oxy)3ethoxybenzylidene)5hydroxy2phenyl24dihydro3Hpyrazol3one
CCOc1cc(ccc1OCc1c(F)cccc1Cl)C=C1C(=NN(C1=O)c1ccccc1)O
MFCD02071633
ZINC000000666022
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