Vitas-M small molecule compound

[3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl][1-(ethylsulfonyl)piperidin-3-yl]methanone

Catalog ID
STL178099
SMILES CCS(=O)(=O)N1CCCC(C1)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 C13H19F4N3O4S MW 389.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H19F4N3O4S/c1-2-25(23,24)19-5-3-4-8(7-19)11(21)20-13(22,12(16)17)6-9(18-20)10(14)15/h8,10,12,22H,2-7H2,1H3
InChIKey
LVVKJVPIVOLVJJ-UHFFFAOYSA-N
Synonyms
832119-15-0
(35bis(difluoromethyl)5hydroxy45dihydro1Hpyrazol1yl)(1(ethylsulfonyl)piperidin3yl)methanone
(35bis(difluoromethyl)5hydroxy4Hpyrazol1yl)(1ethylsulfonylpiperidin3yl)methanone
832119150
CCS(=O)(=O)N1CCCC(C1)C(=O)N2C(CC(=N2)C(F)F)(C(F)F)O
InChI=1SC13H19F4N3O4Sc1225(2324)195348(719)11(21)2013(2212(16)17)69(1820)10(14)15h8101222H27H21H3
MFCD04134225
ZINC000006554733
ZINC000245253727

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.