Vitas-M small molecule compound
2-methylpropyl cyano(3-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}quinoxalin-2-yl)acetate
Catalog ID
STK714374
SMILES N#CC(c1nc2ccccc2nc1N1CCN(CC1)c1cccc(c1)C(F)(F)F)C(=O)OCC(C)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 C26H26F3N5O2 MW 497.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26F3N5O2/c1-17(2)16-36-25(35)20(15-30)23-24(32-22-9-4-3-8-21(22)31-23)34-12-10-33(11-13-34)19-7-5-6-18(14-19)26(27,28)29/h3-9,14,17,20H,10-13,16H2,1-2H3InChIKey
YTMFRIGEFHAVJY-UHFFFAOYSA-NSynonyms
840476-94-02METHYLPROPYL2CYANO2(3(4(3(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)QUINOXALIN2YL)ACETATE
2methylpropylcyano(3(4(3(trifluoromethyl)phenyl)piperazin1yl)quinoxalin2yl)acetate
840476940
CC(C)COC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F
InChI=1SC26H26F3N5O2c117(2)163625(35)20(1530)2324(3222943821(22)3123)34121033(111334)1975618(1419)26(2728)29h39141720H101316H212H3
isobutyl2cyano2(3(4(3(trifluoromethyl)phenyl)piperazin1yl)quinoxalin2yl)acetate
MFCD04006019
ZINC000002262890
ZINC000002262891
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