Vitas-M small molecule compound
(2Z)-7-(azepan-1-ylmethyl)-2-[(1-ethyl-5-methoxy-1H-indol-3-yl)methylidene]-6-hydroxy-1-benzofuran-3(2H)-one
Catalog ID
STL034998
SMILES COc1ccc2c(c1)c(/C=C/1\Oc3c(C1=O)ccc(c3CN1CCCCCC1)O)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 C27H30N2O4 MW 446.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N2O4/c1-3-29-16-18(21-15-19(32-2)8-10-23(21)29)14-25-26(31)20-9-11-24(30)22(27(20)33-25)17-28-12-6-4-5-7-13-28/h8-11,14-16,30H,3-7,12-13,17H2,1-2H3/b25-14-InChIKey
RFWKINAAPLKRNK-QFEZKATASA-NSynonyms
(2Z)7(azepan1ylmethyl)2((1ethyl5methoxy1Hindol3yl)methylidene)6hydroxy1benzofuran3(2H)one
(2Z)7(azepan1ylmethyl)2((1ethyl5methoxyindol3yl)methylidene)6hydroxy1benzofuran3one
(E)7(azepan1ylmethyl)2((1ethyl5methoxy1Hindol3yl)methylene)6hydroxybenzofuran3(2H)one
7(AZAPERHYDROEPINYLMETHYL)2((1ETHYL5METHOXYINDOL3YL)METHYLENE)6HYDROXYBENZO(B)FURAN3ONE
COc1ccc2c(c1)c(C=C1Oc3c(C1=O)ccc(c3CN1CCCCCC1)O)cn2CC
InChI=1SC27H30N2O4c13291618(211519(322)81023(21)29)142526(31)2091124(30)22(27(20)3325)17281264571328h811141630H37121317H212H3b2514
MFCD18191955
ZINC000028182810
ZINC28182810
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