Vitas-M small molecule compound
2-{[(E)-{2-[(4-bromobenzyl)oxy]phenyl}methylidene]amino}hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
Catalog ID
STK264046
SMILES Brc1ccc(cc1)COc1ccccc1/C=N/N1C(=O)C2C(C1=O)C1C=CC2C2C1C2
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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 C25H21BrN2O3 MW 477.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21BrN2O3/c26-16-7-5-14(6-8-16)13-31-21-4-2-1-3-15(21)12-27-28-24(29)22-17-9-10-18(20-11-19(17)20)23(22)25(28)30/h1-10,12,17-20,22-23H,11,13H2/b27-12+InChIKey
AEQRFIBCXXEWNK-KKMKTNMSSA-NSynonyms
2(((E)(2((4BROMOBENZYL)OXY)PHENYL)METHYLIDENE)AMINO)HEXAHYDRO46ETHENOCYCLOPROPA(F)ISOINDOLE13(2H3AH)DIONE
Brc1ccc(cc1)COc1ccccc1C=NN1C(=O)C2C(C1=O)C1C=CC2C2C1C2
C1C2C1C3C=CC2C4C3C(=O)N(C4=O)N=CC5=CC=CC=C5OCC6=CC=C(C=C6)Br
InChI=1SC25H21BrN2O3c26167514(6816)133121421315(21)12272824(29)221791018(201119(17)20)23(22)25(28)30h1101217202223H1113H2b2712+
MFCD03552338
ZINC000245226516
ZINC000245226519
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