Vitas-M small molecule compound

(2E)-3-(4-nitrophenyl)-1-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}prop-2-en-1-one

Catalog ID
STK301260
SMILES O=C(N1CCN(CC1)c1cccc(c1)C(F)(F)F)/C=C/c1ccc(cc1)[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 C20H18F3N3O3 MW 405.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18F3N3O3/c21-20(22,23)16-2-1-3-18(14-16)24-10-12-25(13-11-24)19(27)9-6-15-4-7-17(8-5-15)26(28)29/h1-9,14H,10-13H2/b9-6+
InChIKey
ZAOYZUCRAFMRDG-RMKNXTFCSA-N
Synonyms
546088-69-1
(2E)3(4nitrophenyl)1(4(3(trifluoromethyl)phenyl)piperazin1yl)prop2en1one
(E)3(4NITROPHENYL)1(4(3(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)PROP2EN1ONE
546088691
C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=O)C=CC3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC20H18F3N3O3c2120(2223)1621318(1416)24101225(131124)19(27)96154717(8515)26(28)29h1914H1013H2b96+
MFCD03394560
O=C(N1CCN(CC1)c1cccc(c1)C(F)(F)F)C=Cc1ccc(cc1)(N+)(=O)(O)
ZINC000001116794
ZINC01116794
ZINC1116794

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Available files

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