Vitas-M small molecule compound
(2E)-2-[(1-ethyl-5-methoxy-1H-indol-3-yl)methylidene]-7-methyl-3-oxo-2,3-dihydro-1-benzofuran-6-yl benzenesulfonate
Catalog ID
STK623372
SMILES COc1ccc2c(c1)c(/C=C\1/Oc3c(C1=O)ccc(c3C)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 C27H23NO6S MW 489.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23NO6S/c1-4-28-16-18(22-15-19(32-3)10-12-23(22)28)14-25-26(29)21-11-13-24(17(2)27(21)33-25)34-35(30,31)20-8-6-5-7-9-20/h5-16H,4H2,1-3H3/b25-14+InChIKey
WBULZQBDCBXANO-AFUMVMLFSA-NSynonyms
929512-08-3((2E)2((1ethyl5methoxyindol3yl)methylidene)7methyl3oxo1benzofuran6yl)benzenesulfonate
(2E)2((1ethyl5methoxy1Hindol3yl)methylidene)7methyl3oxo23dihydro1benzofuran6ylbenzenesulfonate
(E)2((1ethyl5methoxy1Hindol3yl)methylene)7methyl3oxo23dihydrobenzofuran6ylbenzenesulfonate
2((1ETHYL5METHOXYINDOL3YL)METHYLENE)7METHYL3OXOBENZO(34B)FURAN6YLBENZENESULFONATE
929512083
CCN1C=C(C2=C1C=CC(=C2)OC)C=C3C(=O)C4=C(O3)C(=C(C=C4)OS(=O)(=O)C5=CC=CC=C5)C
COc1ccc2c(c1)c(C=C1Oc3c(C1=O)ccc(c3C)OS(=O)(=O)c1ccccc1)cn2CC
InChI=1SC27H23NO6Sc14281618(221519(323)101223(22)28)142526(29)21111324(17(2)27(21)3325)3435(3031)208657920h516H4H213H3b2514+
MFCD09792653
ZINC000008992230
ZINC08992230
ZINC8992230
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