Vitas-M small molecule compound
(4Z)-4-{5-bromo-2-[(4-fluorobenzyl)oxy]benzylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK096044
SMILES Brc1ccc(c(c1)/C=C\1/C(=NN(C1=O)c1ccccc1)C)OCc1ccc(cc1)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)21-5-3-2-4-6-21)14-18-13-19(25)9-12-23(18)30-15-17-7-10-20(26)11-8-17/h2-14H,15H2,1H3/b22-14-InChIKey
UCEMJNJFKXZJPO-HMAPJEAMSA-NSynonyms
(4Z)4((5BROMO2((4FLUOROPHENYL)METHOXY)PHENYL)METHYLIDENE)5METHYL2PHENYLPYRAZOL3ONE
(4Z)4(5BROMO2((4FLUOROBENZYL)OXY)BENZYLIDENE)5METHYL2PHENYL24DIHYDRO3HPYRAZOL3ONE
Brc1ccc(c(c1)C=C1C(=NN(C1=O)c1ccccc1)C)OCc1ccc(cc1)F
CC1=NN(C(=O)C1=CC2=C(C=CC(=C2)Br)OCC3=CC=C(C=C3)F)C4=CC=CC=C4
InChI=1SC24H18BrFN2O2c11622(24(29)28(2716)215324621)14181319(25)91223(18)30151771020(26)11817h214H15H21H3b2214
MFCD02121249
STK096044
ZINC000013895518
ZINC13895518
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