Vitas-M small molecule compound
(4E)-4-{5-bromo-2-[(3-fluorobenzyl)oxy]benzylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK160401
SMILES Brc1ccc(c(c1)/C=C/1\C(=NN(C1=O)c1ccccc1)C)OCc1cccc(c1)F
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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 C24H18BrFN2O2 MW 465.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18BrFN2O2/c1-16-22(24(29)28(27-16)21-8-3-2-4-9-21)14-18-13-19(25)10-11-23(18)30-15-17-6-5-7-20(26)12-17/h2-14H,15H2,1H3/b22-14+InChIKey
BVZBLFPGNVFWIQ-HYARGMPZSA-NSynonyms
(4E)4((5BROMO2((3FLUOROPHENYL)METHOXY)PHENYL)METHYLIDENE)5METHYL2PHENYLPYRAZOL3ONE
(4E)4(5BROMO2((3FLUOROBENZYL)OXY)BENZYLIDENE)5METHYL2PHENYL24DIHYDRO3HPYRAZOL3ONE
Brc1ccc(c(c1)C=C1C(=NN(C1=O)c1ccccc1)C)OCc1cccc(c1)F
CC1=NN(C(=O)C1=CC2=C(C=CC(=C2)Br)OCC3=CC(=CC=C3)F)C4=CC=CC=C4
InChI=1SC24H18BrFN2O2c11622(24(29)28(2716)218324921)14181319(25)101123(18)30151765720(26)1217h214H15H21H3b2214+
MFCD04503480
ZINC000100233101
ZINC100233101
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