Vitas-M small molecule compound
(4Z)-2-(4-chlorophenyl)-4-(3-ethoxy-4-hydroxy-5-nitrobenzylidene)-5-(trifluoromethyl)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL432534
SMILES CCOc1cc(/C=C/2\C(=O)N(N=C2C(F)(F)F)c2ccc(cc2)Cl)cc(c1O)[N+](=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 C19H13ClF3N3O5 MW 455.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13ClF3N3O5/c1-2-31-15-9-10(8-14(16(15)27)26(29)30)7-13-17(19(21,22)23)24-25(18(13)28)12-5-3-11(20)4-6-12/h3-9,27H,2H2,1H3/b13-7-InChIKey
KJHDESSHBKXARO-QPEQYQDCSA-NSynonyms
(4Z)2(4chlorophenyl)4(3ethoxy4hydroxy5nitrobenzylidene)5(trifluoromethyl)24dihydro3Hpyrazol3one
CCOc1cc(C=C2C(=O)N(N=C2C(F)(F)F)c2ccc(cc2)Cl)cc(c1O)(N+)(=O)(O)
MFCD02908125
ZINC000016116175
Check stock
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