Vitas-M small molecule compound
(2E)-2-[(1-ethyl-1H-indol-3-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl 3,5-dimethoxybenzoate
Catalog ID
STK628737
SMILES COc1cc(OC)cc(c1)C(=O)Oc1ccc2c(c1)O/C(=C/c1cn(c3c1cccc3)CC)/C2=O
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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 C28H23NO6 MW 469.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23NO6/c1-4-29-16-18(22-7-5-6-8-24(22)29)13-26-27(30)23-10-9-19(15-25(23)35-26)34-28(31)17-11-20(32-2)14-21(12-17)33-3/h5-16H,4H2,1-3H3/b26-13+InChIKey
WTAKICHWMRDQIJ-LGJNPRDNSA-NSynonyms
929444-10-0((2E)2((1ethylindol3yl)methylidene)3oxo1benzofuran6yl)35dimethoxybenzoate
(2E)2((1ethyl1Hindol3yl)methylidene)3oxo23dihydro1benzofuran6yl35dimethoxybenzoate
(E)2((1ethyl1Hindol3yl)methylene)3oxo23dihydrobenzofuran6yl35dimethoxybenzoate
2((1ETHYLINDOL3YL)METHYLENE)3OXOBENZO(34B)FURAN6YL35DIMETHOXYBENZOATE
929444100
CCN1C=C(C2=CC=CC=C21)C=C3C(=O)C4=C(O3)C=C(C=C4)OC(=O)C5=CC(=CC(=C5)OC)OC
COc1cc(OC)cc(c1)C(=O)Oc1ccc2c(c1)OC(=Cc1cn(c3c1cccc3)CC)C2=O
InChI=1SC28H23NO6c14291618(22756824(22)29)132627(30)2310919(1525(23)3526)3428(31)171120(322)1421(1217)333h516H4H213H3b2613+
MFCD09793232
ZINC000009423837
ZINC09423837
ZINC9423837
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