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 4-methylbenzoate
Catalog ID
STK630565
SMILES COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3C)OC(=O)c1ccc(cc1)C)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 C29H25NO5 MW 467.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25NO5/c1-5-30-16-20(23-15-21(33-4)10-12-24(23)30)14-26-27(31)22-11-13-25(18(3)28(22)34-26)35-29(32)19-8-6-17(2)7-9-19/h6-16H,5H2,1-4H3/b26-14+InChIKey
UAYQDSZZLQIWJC-VULFUBBASA-NSynonyms
929477-91-8((2E)2((1ethyl5methoxyindol3yl)methylidene)7methyl3oxo1benzofuran6yl)4methylbenzoate
(2E)2((1ethyl5methoxy1Hindol3yl)methylidene)7methyl3oxo23dihydro1benzofuran6yl4methylbenzoate
(E)2((1ethyl5methoxy1Hindol3yl)methylene)7methyl3oxo23dihydrobenzofuran6yl4methylbenzoate
2((1ETHYL5METHOXYINDOL3YL)METHYLENE)7METHYL3OXOBENZO(34B)FURAN6YL4METHYLBENZOATE
929477918
CCN1C=C(C2=C1C=CC(=C2)OC)C=C3C(=O)C4=C(O3)C(=C(C=C4)OC(=O)C5=CC=C(C=C5)C)C
COc1ccc2c(c1)c(C=C1Oc3c(C1=O)ccc(c3C)OC(=O)c1ccc(cc1)C)cn2CC
InChI=1SC29H25NO5c15301620(231521(334)101224(23)30)142627(31)22111325(18(3)28(22)3426)3529(32)198617(2)7919h616H5H214H3b2614+
MFCD09792574
ZINC000008993200
ZINC08993200
ZINC8993200
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