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 benzenesulfonate
Catalog ID
STK618480
SMILES COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3)OS(=O)(=O)c1ccccc1)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 C26H21NO6S MW 475.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21NO6S/c1-3-27-16-17(22-14-18(31-2)10-12-23(22)27)13-25-26(28)21-11-9-19(15-24(21)32-25)33-34(29,30)20-7-5-4-6-8-20/h4-16H,3H2,1-2H3/b25-13+InChIKey
DBZJJFWBWDUYIR-DHRITJCHSA-NSynonyms
929478-71-7((2E)2((1ethyl5methoxyindol3yl)methylidene)3oxo1benzofuran6yl)benzenesulfonate
(2E)2((1ethyl5methoxy1Hindol3yl)methylidene)3oxo23dihydro1benzofuran6ylbenzenesulfonate
(E)2((1ethyl5methoxy1Hindol3yl)methylene)3oxo23dihydrobenzofuran6ylbenzenesulfonate
2((1ETHYL5METHOXYINDOL3YL)METHYLENE)3OXOBENZO(34B)FURAN6YLBENZENESULFONATE
929478717
CCN1C=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)cn2CC
InChI=1SC26H21NO6Sc13271617(221418(312)101223(22)27)132526(28)2111919(1524(21)3225)3334(2930)207546820h416H3H212H3b2513+
MFCD09795626
ZINC000008993659
ZINC08993659
ZINC8993659
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