Vitas-M small molecule compound

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

Catalog ID
STK421669
SMILES O=C(N1N=C(CC1(O)C(F)(F)F)C1CC1)c1cccc(c1)[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 C14H12F3N3O4 MW 343.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12F3N3O4/c15-14(16,17)13(22)7-11(8-4-5-8)18-19(13)12(21)9-2-1-3-10(6-9)20(23)24/h1-3,6,8,22H,4-5,7H2
InChIKey
OBNZAMPCRCFFGN-UHFFFAOYSA-N
Synonyms
438228-25-2
((5R)3CYCLOPROPYL5HYDROXY5(TRIFLUOROMETHYL)45DIHYDRO1HPYRAZOL1YL)(3NITROPHENYL)METHANONE
(3cyclopropyl5hydroxy5(trifluoromethyl)45dihydro1Hpyrazol1yl)(3nitrophenyl)methanone
(3CYCLOPROPYL5HYDROXY5(TRIFLUOROMETHYL)4HPYRAZOL1YL)(3NITROPHENYL)METHANONE
3CYCLOPROPYL1(3NITROBENZOYL)5(TRIFLUOROMETHYL)45DIHYDRO1HPYRAZOL5OL
438228252
C1CC1C2=NN(C(C2)(C(F)(F)F)O)C(=O)C3=CC(=CC=C3)(N+)(=O)(O)
InChI=1SC14H12F3N3O4c1514(1617)13(22)711(8458)1819(13)12(21)921310(69)20(23)24h136822H457H2
MFCD03466669
O=C(N1N=C(CC1(O)C(F)(F)F)C1CC1)c1cccc(c1)(N+)(=O)(O)
ZINC000001012084
ZINC000001012085

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Available files

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