Vitas-M small molecule compound

[3-ethyl-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl](pyridin-3-yl)methanone

Catalog ID
STK877293
SMILES CCC1=NN(C(C1)(O)C(F)(F)F)C(=O)c1cccnc1

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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 C12H12F3N3O2 MW 287.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12F3N3O2/c1-2-9-6-11(20,12(13,14)15)18(17-9)10(19)8-4-3-5-16-7-8/h3-5,7,20H,2,6H2,1H3
InChIKey
JDEPCGBGWGSUAO-UHFFFAOYSA-N
Synonyms

(3ethyl5hydroxy5(trifluoromethyl)45dihydro1Hpyrazol1yl)(pyridin3yl)methanone
(3ETHYL5HYDROXY5(TRIFLUOROMETHYL)4HPYRAZOL1YL)PYRIDIN3YLMETHANONE
(3ETHYL5HYDROXY5TRIFLUOROMETHYL45DIHYDROPYRAZOL1YL)PYRIDIN3YLMETHANONE
3ETHYL5HYDROXY5(TRIFLUOROMETHYL)(2PYRAZOLINYL)3PYRIDYLKETONE
CCC1=NN(C(C1)(C(F)(F)F)O)C(=O)C2=CN=CC=C2
InChI=1SC12H12F3N3O2c129611(2012(1314)15)18(179)10(19)84351678h35720H26H21H3
MFCD01080533
ZINC000000313453
ZINC000000313457

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Available files

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