Vitas-M small molecule compound
[5-hydroxy-5-(pyridin-3-yl)-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl](2-nitrophenyl)methanone
Catalog ID
STK756841
SMILES O=C(N1N=C(CC1(O)c1cccnc1)C(F)(F)F)c1ccccc1[N+](=O)[O-]
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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 C16H11F3N4O4 MW 380.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11F3N4O4/c17-16(18,19)13-8-15(25,10-4-3-7-20-9-10)22(21-13)14(24)11-5-1-2-6-12(11)23(26)27/h1-7,9,25H,8H2InChIKey
NHKJREQESKCBEP-UHFFFAOYSA-NSynonyms
311789-16-9(5hydroxy5(pyridin3yl)3(trifluoromethyl)45dihydro1Hpyrazol1yl)(2nitrophenyl)methanone
(5HYDROXY5PYRIDIN3YL3(TRIFLUOROMETHYL)4HPYRAZOL1YL)(2NITROPHENYL)METHANONE
1(2NITROBENZOYL)5(3PYRIDINYL)3(TRIFLUOROMETHYL)45DIHYDRO1HPYRAZOL5OL
2PYRAZOLIN5OL3TRIFLUOROMETHYL1(2NITROBENZOYL)5(3PYRIDYL)
311789169
5HYDROXY5(3PYRIDYL)3(TRIFLUOROMETHYL)(2PYRAZOLINYL)2NITROPHENYLKETONE
C1C(=NN(C1(C2=CN=CC=C2)O)C(=O)C3=CC=CC=C3(N+)(=O)(O))C(F)(F)F
InChI=1SC16H11F3N4O4c1716(1819)13815(251043720910)22(2113)14(24)11512612(11)23(26)27h17925H8H2
MFCD00782085
O=C(N1N=C(CC1(O)c1cccnc1)C(F)(F)F)c1ccccc1(N+)(=O)(O)
ZINC000000827423
ZINC000000827424
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.