Vitas-M small molecule compound
(4Z)-4-{4-[(4-chlorobenzyl)oxy]-3-methoxybenzylidene}-2-(4-fluorophenyl)-5-hydroxy-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL507714
SMILES COc1cc(ccc1OCc1ccc(cc1)Cl)/C=C\1/C(=NN(C1=O)c1ccc(cc1)F)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 C24H18ClFN2O4 MW 452.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18ClFN2O4/c1-31-22-13-16(4-11-21(22)32-14-15-2-5-17(25)6-3-15)12-20-23(29)27-28(24(20)30)19-9-7-18(26)8-10-19/h2-13H,14H2,1H3,(H,27,29)/b20-12-InChIKey
MFLWQXIXHSHUSH-NDENLUEZSA-NSynonyms
(4~(Z))4((4((4chlorophenyl)methoxy)3methoxyphenyl)methylidene)1(4fluorophenyl)pyrazolidine35dione
(4Z)4((4((4CHLOROPHENYL)METHOXY)3METHOXYPHENYL)METHYLIDENE)1(4FLUOROPHENYL)PYRAZOLIDINE35DIONE
(4Z)4(4((4CHLOROBENZYL)OXY)3METHOXYBENZYLIDENE)1(4FLUOROPHENYL)PYRAZOLIDINE35DIONE
(4Z)4(4((4chlorobenzyl)oxy)3methoxybenzylidene)2(4fluorophenyl)5hydroxy24dihydro3Hpyrazol3one
1231581
4(4((4CHLOROBENZYL)OXY)3METHOXYBENZYLIDENE)1(4FLUOROPHENYL)35PYRAZOLIDINEDIONE
InChI=1SC24H18ClFN2O4c131221316(41121(22)3214152517(25)6315)122023(29)2728(24(20)30)199718(26)81019h213H14H21H3(H2729)b2012
MFCD31615420
ZINC000001011732
ZINC1011732
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