Vitas-M small molecule compound
3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-1-[5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]propan-1-one
Catalog ID
STK311582
SMILES O=C(N1N=CCC1(O)C(F)(F)F)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 C12H14ClF3N4O2 MW 338.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14ClF3N4O2/c1-7-10(13)8(2)19(18-7)6-3-9(21)20-11(22,4-5-17-20)12(14,15)16/h5,22H,3-4,6H2,1-2H3InChIKey
HEBJFBWXKXVCPS-UHFFFAOYSA-NSynonyms
1005577-17-21005577172
3(4chloro35dimethyl1Hpyrazol1yl)1(5hydroxy5(trifluoromethyl)45dihydro1Hpyrazol1yl)propan1one
3(4chloro35dimethylpyrazol1yl)1(5hydroxy5(trifluoromethyl)4Hpyrazol1yl)propan1one
CC1=C(C(=NN1CCC(=O)N2C(CC=N2)(C(F)(F)F)O)C)Cl
InChI=1SC12H14ClF3N4O2c1710(13)8(2)19(187)639(21)2011(22451720)12(1415)16h522H346H212H3
MFCD04138274
ZINC000006921004
ZINC000006921005
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