Vitas-M small molecule compound
(2E)-7-{[butyl(methyl)ammonio]methyl}-2-[(1-ethyl-5-methoxy-1H-indol-3-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK619152
SMILES CCCC[NH+](Cc1c([O-])ccc2c1O/C(=C/c1cn(c3c1cc(OC)cc3)CC)/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 C26H30N2O4 MW 434.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N2O4/c1-5-7-12-27(3)16-21-23(29)11-9-19-25(30)24(32-26(19)21)13-17-15-28(6-2)22-10-8-18(31-4)14-20(17)22/h8-11,13-15,29H,5-7,12,16H2,1-4H3/b24-13+InChIKey
BNCBZIGIGYJUDJ-ZMOGYAJESA-NSynonyms
929512-65-2(2E)7((butyl(methyl)amino)methyl)2((1ethyl5methoxyindol3yl)methylidene)6hydroxy1benzofuran3one
(2E)7((butyl(methyl)ammonio)methyl)2((1ethyl5methoxy1Hindol3yl)methylidene)3oxo23dihydro1benzofuran6olate
929512652
CCCC(NH+)(Cc1c((O))ccc2c1OC(=Cc1cn(c3c1cc(OC)cc3)CC)C2=O)C
CCCCN(C)CC1=C(C=CC2=C1OC(=CC3=CN(C4=C3C=C(C=C4)OC)CC)C2=O)O
InChI=1SC26H30N2O4c1571227(3)162123(29)1191925(30)24(3226(19)21)13171528(62)2210818(314)1420(17)22h811131529H571216H214H3b2413+
MFCD09796063
ZINC000020646651
ZINC20646651
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