Vitas-M small molecule compound

1-[3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-nitro-1H-pyrazol-1-yl)propan-1-one

Catalog ID
STK305957
SMILES CC(n1ncc(c1)[N+](=O)[O-])C(=O)N1N=C(CC1(O)C(F)F)C(F)F

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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 C11H11F4N5O4 MW 353.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H11F4N5O4/c1-5(18-4-6(3-16-18)20(23)24)9(21)19-11(22,10(14)15)2-7(17-19)8(12)13/h3-5,8,10,22H,2H2,1H3
InChIKey
OQBTYYNLAVAYNZ-UHFFFAOYSA-N
Synonyms
1005613-49-9
1(35bis(difluoromethyl)5hydroxy45dihydro1Hpyrazol1yl)2(4nitro1Hpyrazol1yl)propan1one
1(35bis(difluoromethyl)5hydroxy4Hpyrazol1yl)2(4nitropyrazol1yl)propan1one
1005613499
CC(C(=O)N1C(CC(=N1)C(F)F)(C(F)F)O)N2C=C(C=N2)(N+)(=O)(O)
CC(n1ncc(c1)(N+)(=O)(O))C(=O)N1N=C(CC1(O)C(F)F)C(F)F
InChI=1SC11H11F4N5O4c15(1846(31618)20(23)24)9(21)1911(2210(14)15)27(1719)8(12)13h3581022H2H21H3
MFCD04046251
ZINC000006520690
ZINC000006524217

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Available files

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