Vitas-M small molecule compound
benzyl cyano(3-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}quinoxalin-2-yl)acetate
Catalog ID
STL226034
SMILES N#CC(c1nc2ccccc2nc1N1CCN(CC1)c1cccc(c1)C(F)(F)F)C(=O)OCc1ccccc1
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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 C29H24F3N5O2 MW 531.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24F3N5O2/c30-29(31,32)21-9-6-10-22(17-21)36-13-15-37(16-14-36)27-26(34-24-11-4-5-12-25(24)35-27)23(18-33)28(38)39-19-20-7-2-1-3-8-20/h1-12,17,23H,13-16,19H2InChIKey
YNXVIOWMRZEARP-UHFFFAOYSA-NSynonyms
587005-79-6587005796
BENZYL2CYANO2(3(4(3(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)QUINOXALIN2YL)ACETATE
benzylcyano(3(4(3(trifluoromethyl)phenyl)piperazin1yl)quinoxalin2yl)acetate
C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C3=NC4=CC=CC=C4N=C3C(C#N)C(=O)OCC5=CC=CC=C5
InChI=1SC29H24F3N5O2c3029(3132)21961022(1721)36131537(161436)2726(342411451225(24)3527)23(1833)28(38)3919207213820h1121723H131619H2
MFCD04033671
ZINC000002397722
ZINC000002397723
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