Vitas-M small molecule compound
(2E)-2-[(5-methoxy-1-methyl-1H-indol-3-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl (2E)-3-phenylprop-2-enoate
Catalog ID
STK993078
SMILES COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3)OC(=O)/C=C/c1ccccc1)cn2C
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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 C28H21NO5 MW 451.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21NO5/c1-29-17-19(23-15-20(32-2)10-12-24(23)29)14-26-28(31)22-11-9-21(16-25(22)34-26)33-27(30)13-8-18-6-4-3-5-7-18/h3-17H,1-2H3/b13-8+,26-14+InChIKey
SEHNBVDNARSZGU-JHCKZZKFSA-NSynonyms
929444-04-2((2E)2((5methoxy1methylindol3yl)methylidene)3oxo1benzofuran6yl)(E)3phenylprop2enoate
(2E)2((5methoxy1methyl1Hindol3yl)methylidene)3oxo23dihydro1benzofuran6yl(2E)3phenylprop2enoate
(E)2((5methoxy1methyl1Hindol3yl)methylene)3oxo23dihydrobenzofuran6ylcinnamate
2((5METHOXY1METHYLINDOL3YL)METHYLENE)3OXOBENZO(34B)FURAN6YL(2E)3PHENYLPROP2ENOATE
929444042
CN1C=C(C2=C1C=CC(=C2)OC)C=C3C(=O)C4=C(O3)C=C(C=C4)OC(=O)C=CC5=CC=CC=C5
COc1ccc2c(c1)c(C=C1Oc3c(C1=O)ccc(c3)OC(=O)C=Cc1ccccc1)cn2C
InChI=1SC28H21NO5c1291719(231520(322)101224(23)29)142628(31)2211921(1625(22)3426)3327(30)138186435718h317H12H3b138+2614+
MFCD09847759
ZINC000008990712
ZINC08990712
ZINC8990712
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