Vitas-M small molecule compound
3-(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
STK303324
SMILES CC1=NN(C(C1)(O)C(F)(F)F)C(=O)CCn1nc(c(c1C)Cl)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/c1-7-6-12(23,13(15,16)17)21(18-7)10(22)4-5-20-9(3)11(14)8(2)19-20/h23H,4-6H2,1-3H3InChIKey
DFMAPYVRIKIMKA-UHFFFAOYSA-NSynonyms
1005628-02-31005628023
3(4chloro35dimethyl1Hpyrazol1yl)1(5hydroxy3methyl5(trifluoromethyl)45dihydro1Hpyrazol1yl)propan1one
3(4CHLORO35DIMETHYLPYRAZOL1YL)1(5HYDROXY3METHYL5(TRIFLUOROMETHYL)4HPYRAZOL1YL)PROPAN1ONE
CC1=NN(C(C1)(C(F)(F)F)O)C(=O)CCN2C(=C(C(=N2)C)Cl)C
InChI=1SC13H16ClF3N4O2c17612(2313(1516)17)21(187)10(22)45209(3)11(14)8(2)1920h23H46H213H3
MFCD04049308
ZINC000006526297
ZINC000006526308
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