Vitas-M small molecule compound
(2Z)-2-[(5-bromo-1-benzofuran-2-yl)methylidene]-3-oxo-7-(piperidinium-1-ylmethyl)-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK626855
SMILES Brc1ccc2c(c1)cc(o2)/C=C/1\Oc2c(C1=O)ccc(c2C[NH+]1CCCCC1)[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 C23H20BrNO4 MW 454.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20BrNO4/c24-15-4-7-20-14(10-15)11-16(28-20)12-21-22(27)17-5-6-19(26)18(23(17)29-21)13-25-8-2-1-3-9-25/h4-7,10-12,26H,1-3,8-9,13H2/b21-12-InChIKey
DXQJCTRYUOIBLG-MTJSOVHGSA-NSynonyms
929489-03-2(2Z)2((5bromo1benzofuran2yl)methylidene)3oxo7(piperidinium1ylmethyl)23dihydro1benzofuran6olate
2((5BROMOBENZO(D)FURAN2YL)METHYLENE)6HYDROXY7(PIPERIDYLMETHYL)BENZO(B)FURAN3ONE
Brc1ccc2c(c1)cc(o2)C=C1Oc2c(C1=O)ccc(c2C(NH+)1CCCCC1)(O)
MFCD09795889
ZINC000013655286
ZINC13655286
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