Vitas-M small molecule compound
[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]{4-[(4-methoxyphenoxy)methyl]phenyl}methanone
Catalog ID
STK302611
SMILES COc1ccc(cc1)OCc1ccc(cc1)C(=O)N1N=C(CC1(O)C(F)(F)F)C
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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 C20H19F3N2O4 MW 408.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19F3N2O4/c1-13-11-19(27,20(21,22)23)25(24-13)18(26)15-5-3-14(4-6-15)12-29-17-9-7-16(28-2)8-10-17/h3-10,27H,11-12H2,1-2H3InChIKey
GBXUTHDPRUJKFH-UHFFFAOYSA-NSynonyms
723253-22-3(5hydroxy3methyl5(trifluoromethyl)45dihydro1Hpyrazol1yl)(4((4methoxyphenoxy)methyl)phenyl)methanone
(5HYDROXY3METHYL5(TRIFLUOROMETHYL)4HPYRAZOL1YL)(4((4METHOXYPHENOXY)METHYL)PHENYL)METHANONE
1(4((4METHOXYPHENOXY)METHYL)BENZOYL)3METHYL5(TRIFLUOROMETHYL)45DIHYDRO1HPYRAZOL5OL
723253223
CC1=NN(C(C1)(C(F)(F)F)O)C(=O)C2=CC=C(C=C2)COC3=CC=C(C=C3)OC
InChI=1SC20H19F3N2O4c1131119(2720(2122)23)25(2413)18(26)155314(4615)1229179716(282)81017h31027H1112H212H3
MFCD04048334
ZINC000000652840
ZINC000000652843
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