Vitas-M small molecule compound
(2Z)-7-{[benzyl(methyl)ammonio]methyl}-2-[(5-bromo-1-benzofuran-2-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK626057
SMILES C[NH+](Cc1c([O-])ccc2c1O/C(=C\c1cc3c(o1)ccc(c3)Br)/C2=O)Cc1ccccc1
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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 C26H20BrNO4 MW 490.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20BrNO4/c1-28(14-16-5-3-2-4-6-16)15-21-22(29)9-8-20-25(30)24(32-26(20)21)13-19-12-17-11-18(27)7-10-23(17)31-19/h2-13,29H,14-15H2,1H3/b24-13-InChIKey
BTKJIDUBIQBQEB-CFRMEGHHSA-NSynonyms
929433-76-1(2Z)7((benzyl(methyl)ammonio)methyl)2((5bromo1benzofuran2yl)methylidene)3oxo23dihydro1benzofuran6olate
2((5BROMOBENZO(D)FURAN2YL)METHYLENE)6HYDROXY7((METHYLBENZYLAMINO)METHYL)BENZO(B)FURAN3ONE
C(NH+)(Cc1c((O))ccc2c1OC(=Cc1cc3c(o1)ccc(c3)Br)C2=O)Cc1ccccc1
MFCD09791111
ZINC000020648862
ZINC20648862
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