Vitas-M small molecule compound

[5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl][1-(phenylsulfonyl)piperidin-4-yl]methanone

Catalog ID
STK311136
SMILES O=C(N1N=CCC1(O)C(F)(F)F)C1CCN(CC1)S(=O)(=O)c1ccccc1

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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 C16H18F3N3O4S MW 405.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18F3N3O4S/c17-16(18,19)15(24)8-9-20-22(15)14(23)12-6-10-21(11-7-12)27(25,26)13-4-2-1-3-5-13/h1-5,9,12,24H,6-8,10-11H2
InChIKey
SIIZDQLCTREHRJ-UHFFFAOYSA-N
Synonyms
832143-55-2
(1(benzenesulfonyl)piperidin4yl)(5hydroxy5(trifluoromethyl)4Hpyrazol1yl)methanone
(5hydroxy5(trifluoromethyl)45dihydro1Hpyrazol1yl)(1(phenylsulfonyl)piperidin4yl)methanone
832143552
C1CN(CCC1C(=O)N2C(CC=N2)(C(F)(F)F)O)S(=O)(=O)C3=CC=CC=C3
InChI=1SC16H18F3N3O4Sc1716(1819)15(24)892022(15)14(23)1261021(11712)27(2526)134213513h1591224H681011H2
MFCD04059214
ZINC000006829616
ZINC000006829617

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Available files

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