Vitas-M small molecule compound
2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-1-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]propan-1-one
Catalog ID
STK308699
SMILES CC1=NN(C(C1)(O)C(F)(F)F)C(=O)C(n1nc(c(c1C)Cl)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 C13H16ClF3N4O2 MW 352.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16ClF3N4O2/c1-6-5-12(23,13(15,16)17)21(18-6)11(22)9(4)20-8(3)10(14)7(2)19-20/h9,23H,5H2,1-4H3InChIKey
BQLZOIDOZHVFDT-UHFFFAOYSA-NSynonyms
1005604-43-21005604432
2(4chloro35dimethyl1Hpyrazol1yl)1(5hydroxy3methyl5(trifluoromethyl)45dihydro1Hpyrazol1yl)propan1one
2(4CHLORO35DIMETHYLPYRAZOL1YL)1(5HYDROXY3METHYL5(TRIFLUOROMETHYL)4HPYRAZOL1YL)PROPAN1ONE
CC1=NN(C(C1)(C(F)(F)F)O)C(=O)C(C)N2C(=C(C(=N2)C)Cl)C
InChI=1SC13H16ClF3N4O2c16512(2313(1516)17)21(186)11(22)9(4)208(3)10(14)7(2)1920h923H5H214H3
MFCD04051189
ZINC000006526566
ZINC000006526583
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