Vitas-M small molecule compound
1-[3-butyl-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-[5-methyl-2-(propan-2-yl)phenoxy]ethanone
Catalog ID
STL363904
SMILES CCCCC1=NN(C(C1)(O)C(F)(F)F)C(=O)COc1cc(C)ccc1C(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 C20H27F3N2O3 MW 400.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27F3N2O3/c1-5-6-7-15-11-19(27,20(21,22)23)25(24-15)18(26)12-28-17-10-14(4)8-9-16(17)13(2)3/h8-10,13,27H,5-7,11-12H2,1-4H3InChIKey
FZXHAVUXGBCYFT-UHFFFAOYSA-NSynonyms
383894-48-21(3butyl5hydroxy5(trifluoromethyl)45dihydro1Hpyrazol1yl)2(2isopropyl5methylphenoxy)ethanone
1(3butyl5hydroxy5(trifluoromethyl)45dihydro1Hpyrazol1yl)2(5methyl2(propan2yl)phenoxy)ethanone
1(3BUTYL5HYDROXY5(TRIFLUOROMETHYL)4HPYRAZOL1YL)2(5METHYL2PROPAN2YLPHENOXY)ETHANONE
383894482
CCCCC1=NN(C(C1)(C(F)(F)F)O)C(=O)COC2=C(C=CC(=C2)C)C(C)C
InChI=1SC20H27F3N2O3c1567151119(2720(2122)23)25(2415)18(26)1228171014(4)8916(17)13(2)3h8101327H571112H214H3
MFCD02912079
ZINC000005024521
ZINC000005024522
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