Vitas-M small molecule compound
(2E)-2-[(1-ethyl-1H-indol-3-yl)methylidene]-7-methyl-3-oxo-2,3-dihydro-1-benzofuran-6-yl 4-methylbenzoate
Catalog ID
STK992965
SMILES CCn1cc(c2c1cccc2)/C=C\1/Oc2c(C1=O)ccc(c2C)OC(=O)c1ccc(cc1)C
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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 C28H23NO4 MW 437.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23NO4/c1-4-29-16-20(21-7-5-6-8-23(21)29)15-25-26(30)22-13-14-24(18(3)27(22)32-25)33-28(31)19-11-9-17(2)10-12-19/h5-16H,4H2,1-3H3/b25-15+InChIKey
XHXLKYJBFVAGKL-MFKUBSTISA-NSynonyms
929511-25-1((2E)2((1ethylindol3yl)methylidene)7methyl3oxo1benzofuran6yl)4methylbenzoate
(2E)2((1ethyl1Hindol3yl)methylidene)7methyl3oxo23dihydro1benzofuran6yl4methylbenzoate
(E)2((1ethyl1Hindol3yl)methylene)7methyl3oxo23dihydrobenzofuran6yl4methylbenzoate
2((1ETHYLINDOL3YL)METHYLENE)7METHYL3OXOBENZO(34B)FURAN6YL4METHYLBENZOATE
929511251
CCN1C=C(C2=CC=CC=C21)C=C3C(=O)C4=C(O3)C(=C(C=C4)OC(=O)C5=CC=C(C=C5)C)C
CCn1cc(c2c1cccc2)C=C1Oc2c(C1=O)ccc(c2C)OC(=O)c1ccc(cc1)C
InChI=1SC28H23NO4c14291620(21756823(21)29)152526(30)22131424(18(3)27(22)3225)3328(31)1911917(2)101219h516H4H213H3b2515+
MFCD09846991
ZINC000009423620
ZINC09423620
ZINC9423620
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