Vitas-M small molecule compound
(2E)-7-[(diethylammonio)methyl]-2-[(1-ethyl-5-methoxy-1H-indol-3-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-olate
Catalog ID
STK624906
SMILES COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3C[NH+](CC)CC)[O-])cn2CC
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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 C25H28N2O4 MW 420.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N2O4/c1-5-26(6-2)15-20-22(28)11-9-18-24(29)23(31-25(18)20)12-16-14-27(7-3)21-10-8-17(30-4)13-19(16)21/h8-14,28H,5-7,15H2,1-4H3/b23-12+InChIKey
YUVCHTLMUHXDEE-FSJBWODESA-NSynonyms
929402-37-9(2E)7((diethylammonio)methyl)2((1ethyl5methoxy1Hindol3yl)methylidene)3oxo23dihydro1benzofuran6olate
(2E)7(diethylaminomethyl)2((1ethyl5methoxyindol3yl)methylidene)6hydroxy1benzofuran3one
929402379
CCN1C=C(C2=C1C=CC(=C2)OC)C=C3C(=O)C4=C(O3)C(=C(C=C4)O)CN(CC)CC
COc1ccc2c(c1)c(C=C1Oc3c(C1=O)ccc(c3C(NH+)(CC)CC)(O))cn2CC
InChI=1SC25H28N2O4c1526(62)152022(28)1191824(29)23(3125(18)20)12161427(73)2110817(304)1319(16)21h81428H5715H214H3b2312+
MFCD09792983
ZINC000020650978
ZINC20650978
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