Vitas-M small molecule compound

(2Z)-7-{[benzyl(methyl)amino]methyl}-2-(5-bromo-2-methoxybenzylidene)-6-hydroxy-1-benzofuran-3(2H)-one

Catalog ID
STK992691
SMILES COc1ccc(cc1/C=C/1\Oc2c(C1=O)ccc(c2CN(Cc1ccccc1)C)O)Br

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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 C25H22BrNO4 MW 480.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22BrNO4/c1-27(14-16-6-4-3-5-7-16)15-20-21(28)10-9-19-24(29)23(31-25(19)20)13-17-12-18(26)8-11-22(17)30-2/h3-13,28H,14-15H2,1-2H3/b23-13-
InChIKey
ZUGYXZLIDLMVCB-QRVIBDJDSA-N
Synonyms
929433-86-3
(2Z)7((benzyl(methyl)amino)methyl)2(5bromo2methoxybenzylidene)6hydroxy1benzofuran3(2H)one
(2Z)7((benzyl(methyl)azaniumyl)methyl)2((5bromo2methoxyphenyl)methylidene)3oxo1benzofuran6olate
(Z)7((benzyl(methyl)amino)methyl)2(5bromo2methoxybenzylidene)6hydroxybenzofuran3(2H)one
929433863
C(NH+)(CC1=CC=CC=C1)CC2=C(C=CC3=C2OC(=CC4=C(C=CC(=C4)Br)OC)C3=O)(O)
COc1ccc(cc1C=C1Oc2c(C1=O)ccc(c2CN(Cc1ccccc1)C)O)Br
InChI=1SC25H22BrNO4c127(14166435716)152021(28)1091924(29)23(3125(19)20)13171218(26)81122(17)302h31328H1415H212H3b2313

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Available files

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