Vitas-M small molecule compound

(2E)-2-[(1-ethyl-5-methoxy-1H-indol-3-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl 4-fluorobenzenesulfonate

Catalog ID
STK623201
SMILES COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3)OS(=O)(=O)c1ccc(cc1)F)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 C26H20FNO6S MW 493.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20FNO6S/c1-3-28-15-16(22-13-18(32-2)7-11-23(22)28)12-25-26(29)21-10-6-19(14-24(21)33-25)34-35(30,31)20-8-4-17(27)5-9-20/h4-15H,3H2,1-2H3/b25-12+
InChIKey
FZGLNXPXTAYKMJ-BRJLIKDPSA-N
Synonyms
929380-92-7
((2E)2((1ethyl5methoxyindol3yl)methylidene)3oxo1benzofuran6yl)4fluorobenzenesulfonate
(2E)2((1ethyl5methoxy1Hindol3yl)methylidene)3oxo23dihydro1benzofuran6yl4fluorobenzenesulfonate
(E)2((1ethyl5methoxy1Hindol3yl)methylene)3oxo23dihydrobenzofuran6yl4fluorobenzenesulfonate
2((1ETHYL5METHOXYINDOL3YL)METHYLENE)3OXOBENZO(34B)FURAN6YL4FLUOROBENZENESULFONATE
929380927
CCN1C=C(C2=C1C=CC(=C2)OC)C=C3C(=O)C4=C(O3)C=C(C=C4)OS(=O)(=O)C5=CC=C(C=C5)F
COc1ccc2c(c1)c(C=C1Oc3c(C1=O)ccc(c3)OS(=O)(=O)c1ccc(cc1)F)cn2CC
InChI=1SC26H20FNO6Sc13281516(221318(322)71123(22)28)122526(29)2110619(1424(21)3325)3435(3031)208417(27)5920h415H3H212H3b2512+
MFCD09796607
ZINC000009423505
ZINC09423505
ZINC9423505

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Available files

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