Vitas-M small molecule compound
(4Z)-2-(4-ethylphenyl)-5-hydroxy-4-[(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL505628
SMILES CCc1ccc(cc1)N1N=C(/C(=C/c2c(C)nn(c2O)c2ccccc2)/C1=O)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 C22H20N4O3 MW 388.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O3/c1-3-15-9-11-17(12-10-15)26-22(29)19(20(27)24-26)13-18-14(2)23-25(21(18)28)16-7-5-4-6-8-16/h4-13,28H,3H2,1-2H3,(H,24,27)/b19-13-InChIKey
ZQLITSLZUQXHOS-UYRXBGFRSA-NSynonyms
(4Z)2(4ethylphenyl)5hydroxy4((5hydroxy3methyl1phenyl1Hpyrazol4yl)methylidene)24dihydro3Hpyrazol3one
InChI=1SC22H20N4O3c131591117(121015)2622(29)19(20(27)2426)131814(2)2325(21(18)28)167546816h41328H3H212H3(H2427)b1913
MFCD31538873
ZINC000022215398
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