Vitas-M small molecule compound
1-[3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]-3-(4-bromo-3-methyl-1H-pyrazol-1-yl)propan-1-one
Catalog ID
STK303465
SMILES O=C(N1N=C(CC1(O)C(F)F)C(F)F)CCn1cc(c(n1)C)Br
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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 C12H13BrF4N4O2 MW 401.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13BrF4N4O2/c1-6-7(13)5-20(18-6)3-2-9(22)21-12(23,11(16)17)4-8(19-21)10(14)15/h5,10-11,23H,2-4H2,1H3InChIKey
ZTGDQYFVLGKHIN-UHFFFAOYSA-NSynonyms
1005607-99-71(35bis(difluoromethyl)5hydroxy45dihydro1Hpyrazol1yl)3(4bromo3methyl1Hpyrazol1yl)propan1one
1(35bis(difluoromethyl)5hydroxy4Hpyrazol1yl)3(4bromo3methylpyrazol1yl)propan1one
1005607997
CC1=NN(C=C1Br)CCC(=O)N2C(CC(=N2)C(F)F)(C(F)F)O
InChI=1SC12H13BrF4N4O2c167(13)520(186)329(22)2112(2311(16)17)48(1921)10(14)15h5101123H24H21H3
MFCD04052325
ZINC000006527443
ZINC000006527447
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