Vitas-M small molecule compound
(2E)-7-{[butyl(methyl)ammonio]methyl}-2-[(1-methyl-1H-indol-3-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK628214
SMILES CCCC[NH+](Cc1c([O-])ccc2c1O/C(=C/c1cn(c3c1cccc3)C)/C2=O)C
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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 C24H26N2O3 MW 390.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N2O3/c1-4-5-12-25(2)15-19-21(27)11-10-18-23(28)22(29-24(18)19)13-16-14-26(3)20-9-7-6-8-17(16)20/h6-11,13-14,27H,4-5,12,15H2,1-3H3/b22-13+InChIKey
WZHNZYLKAMYZLN-LPYMAVHISA-NSynonyms
929488-95-9(2E)7((butyl(methyl)ammonio)methyl)2((1methyl1Hindol3yl)methylidene)3oxo23dihydro1benzofuran6olate
(2E)7((butyl(methyl)azaniumyl)methyl)2((1methylindol3yl)methylidene)3oxo1benzofuran6olate
929488959
CCCC(NH+)(Cc1c((O))ccc2c1OC(=Cc1cn(c3c1cccc3)C)C2=O)C
InChI=1SC24H26N2O3c1451225(2)151921(27)11101823(28)22(2924(18)19)13161426(3)20976817(16)20h611131427H451215H213H3b2213+
MFCD09798177
ZINC000020648745
ZINC20648745
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