Vitas-M small molecule compound
1-[3-(4-bromophenyl)-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(3,4-dimethylphenoxy)ethanone
Catalog ID
STK877803
SMILES Brc1ccc(cc1)C1=NN(C(C1)(O)C(F)(F)F)C(=O)COc1ccc(c(c1)C)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 C20H18BrF3N2O3 MW 471.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18BrF3N2O3/c1-12-3-8-16(9-13(12)2)29-11-18(27)26-19(28,20(22,23)24)10-17(25-26)14-4-6-15(21)7-5-14/h3-9,28H,10-11H2,1-2H3InChIKey
JCXFOPSPPOVCLT-UHFFFAOYSA-NSynonyms
369393-34-01(3(4bromophenyl)5hydroxy5(trifluoromethyl)45dihydro1Hpyrazol1yl)2(34dimethylphenoxy)ethanone
1(3(4BROMOPHENYL)5HYDROXY5(TRIFLUOROMETHYL)4HPYRAZOL1YL)2(34DIMETHYLPHENOXY)ETHANONE
369393340
CC1=C(C=C(C=C1)OCC(=O)N2C(CC(=N2)C3=CC=C(C=C3)Br)(C(F)(F)F)O)C
InChI=1SC20H18BrF3N2O3c1123816(913(12)2)291118(27)2619(2820(2223)24)1017(2526)144615(21)7514h3928H1011H212H3
MFCD02912305
ZINC000013659851
ZINC000013659854
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