Vitas-M small molecule compound
(2E)-7-{[bis(2-methoxyethyl)ammonio]methyl}-2-[(1-methyl-1H-indol-3-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK628337
SMILES COCC[NH+](Cc1c([O-])ccc2c1O/C(=C/c1cn(c3c1cccc3)C)/C2=O)CCOC
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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 C25H28N2O5 MW 436.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N2O5/c1-26-15-17(18-6-4-5-7-21(18)26)14-23-24(29)19-8-9-22(28)20(25(19)32-23)16-27(10-12-30-2)11-13-31-3/h4-9,14-15,28H,10-13,16H2,1-3H3/b23-14+InChIKey
BPCMLZAYQKZXQE-OEAKJJBVSA-NSynonyms
929488-77-7(2E)7((bis(2methoxyethyl)ammonio)methyl)2((1methyl1Hindol3yl)methylidene)3oxo23dihydro1benzofuran6olate
(2E)7((bis(2methoxyethyl)azaniumyl)methyl)2((1methylindol3yl)methylidene)3oxo1benzofuran6olate
929488777
COCC(NH+)(Cc1c((O))ccc2c1OC(=Cc1cn(c3c1cccc3)C)C2=O)CCOC
InChI=1SC25H28N2O5c1261517(18645721(18)26)142324(29)198922(28)20(25(19)3223)1627(1012302)1113313h49141528H101316H213H3b2314+
MFCD09791763
ZINC000020650495
ZINC20650495
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