Vitas-M small molecule compound
(2Z)-7-(azepan-1-ylmethyl)-2-[(5-bromo-1-benzofuran-2-yl)methylidene]-6-hydroxy-1-benzofuran-3(2H)-one
Catalog ID
STK992694
SMILES Brc1ccc2c(c1)cc(o2)/C=C/1\Oc2c(C1=O)ccc(c2CN1CCCCCC1)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 C24H22BrNO4 MW 468.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22BrNO4/c25-16-5-8-21-15(11-16)12-17(29-21)13-22-23(28)18-6-7-20(27)19(24(18)30-22)14-26-9-3-1-2-4-10-26/h5-8,11-13,27H,1-4,9-10,14H2/b22-13-InChIKey
HXIQKJNOMGJPSZ-XKZIYDEJSA-NSynonyms
929488-81-3(2Z)7(azepan1ium1ylmethyl)2((5bromo1benzofuran2yl)methylidene)3oxo1benzofuran6olate
(2Z)7(azepan1ylmethyl)2((5bromo1benzofuran2yl)methylidene)6hydroxy1benzofuran3(2H)one
(Z)7(azepan1ylmethyl)2((5bromobenzofuran2yl)methylene)6hydroxybenzofuran3(2H)one
929488813
Brc1ccc2c(c1)cc(o2)C=C1Oc2c(C1=O)ccc(c2CN1CCCCCC1)O
C1CCC(NH+)(CC1)CC2=C(C=CC3=C2OC(=CC4=CC5=C(O4)C=CC(=C5)Br)C3=O)(O)
InChI=1SC24H22BrNO4c2516582115(1116)1217(2921)132223(28)186720(27)19(24(18)3022)1426931241026h58111327H1491014H2b2213
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