Vitas-M small molecule compound
(2Z)-2-[(5-bromo-1-benzofuran-2-yl)methylidene]-7-[(3,5-dimethylpiperidinium-1-yl)methyl]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK627946
SMILES CC1C[NH+](CC(C1)C)Cc1c([O-])ccc2c1O/C(=C\c1cc3c(o1)ccc(c3)Br)/C2=O
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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 C25H24BrNO4 MW 482.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24BrNO4/c1-14-7-15(2)12-27(11-14)13-20-21(28)5-4-19-24(29)23(31-25(19)20)10-18-9-16-8-17(26)3-6-22(16)30-18/h3-6,8-10,14-15,28H,7,11-13H2,1-2H3/b23-10-InChIKey
WXVVYZNDIKTCAH-RMORIDSASA-NSynonyms
929398-25-4(2Z)2((5bromo1benzofuran2yl)methylidene)7((35dimethylpiperidinium1yl)methyl)3oxo23dihydro1benzofuran6olate
7((35DIMETHYLPIPERIDYL)METHYL)2((5BROMOBENZO(D)FURAN2YL)METHYLENE)6HYDROXYBENZO(B)FURAN3ONE
CC1C(NH+)(CC(C1)C)Cc1c((O))ccc2c1OC(=Cc1cc3c(o1)ccc(c3)Br)C2=O
MFCD09793727
ZINC000013653936
ZINC000020624890
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