Vitas-M small molecule compound

{4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl}[4-(propan-2-yl)phenyl]methanone

Catalog ID
STK206092
SMILES CC(c1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(cc1C(F)(F)F)[N+](=O)[O-])C

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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 C21H22F3N3O3 MW 421.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22F3N3O3/c1-14(2)15-3-5-16(6-4-15)20(28)26-11-9-25(10-12-26)19-8-7-17(27(29)30)13-18(19)21(22,23)24/h3-8,13-14H,9-12H2,1-2H3
InChIKey
XLKVLRRKUDLRBK-UHFFFAOYSA-N
Synonyms

(4(4NITRO2(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)(4(PROPAN2YL)PHENYL)METHANONE
(4(4NITRO2(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)(4PROPAN2YLPHENYL)METHANONE
CC(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)(N+)(=O)(O))C(F)(F)F
CC(c1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(cc1C(F)(F)F)(N+)(=O)(O))C
InChI=1SC21H22F3N3O3c114(2)153516(6415)20(28)2611925(101226)198717(27(29)30)1318(19)21(2223)24h381314H912H212H3
MFCD06633821
ZINC000004740979
ZINC04740979
ZINC4740979

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Available files

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