Vitas-M small molecule compound
(2E)-2-[(1-ethyl-5-methoxy-1H-indol-3-yl)methylidene]-7-methyl-3-oxo-2,3-dihydro-1-benzofuran-6-yl benzoate
Catalog ID
STK993036
SMILES COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3C)OC(=O)c1ccccc1)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 C28H23NO5 MW 453.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23NO5/c1-4-29-16-19(22-15-20(32-3)10-12-23(22)29)14-25-26(30)21-11-13-24(17(2)27(21)33-25)34-28(31)18-8-6-5-7-9-18/h5-16H,4H2,1-3H3/b25-14+InChIKey
XLFKQNCVVVBHRH-AFUMVMLFSA-NSynonyms
929380-76-7((2E)2((1ethyl5methoxyindol3yl)methylidene)7methyl3oxo1benzofuran6yl)benzoate
(2E)2((1ethyl5methoxy1Hindol3yl)methylidene)7methyl3oxo23dihydro1benzofuran6ylbenzoate
(E)2((1ethyl5methoxy1Hindol3yl)methylene)7methyl3oxo23dihydrobenzofuran6ylbenzoate
2((1ETHYL5METHOXYINDOL3YL)METHYLENE)7METHYL3OXOBENZO(34B)FURAN6YLBENZOATE
929380767
CCN1C=C(C2=C1C=CC(=C2)OC)C=C3C(=O)C4=C(O3)C(=C(C=C4)OC(=O)C5=CC=CC=C5)C
InChI=1SC28H23NO5c14291619(221520(323)101223(22)29)142526(30)21111324(17(2)27(21)3325)3428(31)188657918h516H4H213H3b2514+
MFCD09848975
ZINC000008993267
ZINC08993267
ZINC8993267
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