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 benzenesulfonate
Catalog ID
STK993058
SMILES COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3)OS(=O)(=O)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 C25H19NO6S MW 461.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19NO6S/c1-26-15-16(21-13-17(30-2)9-11-22(21)26)12-24-25(27)20-10-8-18(14-23(20)31-24)32-33(28,29)19-6-4-3-5-7-19/h3-15H,1-2H3/b24-12+InChIKey
SMBBMJXYOJZTOI-WYMPLXKRSA-NSynonyms
929478-77-3((2E)2((5methoxy1methylindol3yl)methylidene)3oxo1benzofuran6yl)benzenesulfonate
(2E)2((5methoxy1methyl1Hindol3yl)methylidene)3oxo23dihydro1benzofuran6ylbenzenesulfonate
(E)2((5methoxy1methyl1Hindol3yl)methylene)3oxo23dihydrobenzofuran6ylbenzenesulfonate
2((5METHOXY1METHYLINDOL3YL)METHYLENE)3OXOBENZO(34B)FURAN6YLBENZENESULFONATE
929478773
CN1C=C(C2=C1C=CC(=C2)OC)C=C3C(=O)C4=C(O3)C=C(C=C4)OS(=O)(=O)C5=CC=CC=C5
COc1ccc2c(c1)c(C=C1Oc3c(C1=O)ccc(c3)OS(=O)(=O)c1ccccc1)cn2C
InChI=1SC25H19NO6Sc1261516(211317(302)91122(21)26)122425(27)2010818(1423(20)3124)3233(2829)196435719h315H12H3b2412+
MFCD09845211
ZINC000009422428
ZINC09422428
ZINC9422428
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