Vitas-M small molecule compound
(2E)-7-[(dipropylammonio)methyl]-2-[(1-ethyl-1H-indol-3-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK625673
SMILES CCC[NH+](Cc1c([O-])ccc2c1O/C(=C/c1cn(c3c1cccc3)CC)/C2=O)CCC
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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 C26H30N2O3 MW 418.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N2O3/c1-4-13-27(14-5-2)17-21-23(29)12-11-20-25(30)24(31-26(20)21)15-18-16-28(6-3)22-10-8-7-9-19(18)22/h7-12,15-16,29H,4-6,13-14,17H2,1-3H3/b24-15+InChIKey
KFRKJPAFRNEXTN-BUVRLJJBSA-NSynonyms
929402-49-3(2E)7((dipropylammonio)methyl)2((1ethyl1Hindol3yl)methylidene)3oxo23dihydro1benzofuran6olate
(2E)7((dipropylazaniumyl)methyl)2((1ethylindol3yl)methylidene)3oxo1benzofuran6olate
929402493
CCC(NH+)(Cc1c((O))ccc2c1OC(=Cc1cn(c3c1cccc3)CC)C2=O)CCC
CCC(NH+)(CCC)CC1=C(C=CC2=C1OC(=CC3=CN(C4=CC=CC=C43)CC)C2=O)(O)
InChI=1SC26H30N2O3c141327(1452)172123(29)12112025(30)24(3126(20)21)15181628(63)221087919(18)22h712151629H46131417H213H3b2415+
MFCD09798088
ZINC000020648106
ZINC20648106
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