Vitas-M small molecule compound
(E)-1-benzofuran-2-yl{1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxo-2-(pyridin-3-yl)pyrrolidin-3-ylidene}methanolate
Catalog ID
STK560723
SMILES O=C1C(=O)/C(=C(\c2cc3c(o2)cccc3)/[O-])/C(N1CCC[NH+]1CCOCC1)c1cccnc1
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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 C25H25N3O5 MW 447.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O5/c29-23(20-15-17-5-1-2-7-19(17)33-20)21-22(18-6-3-8-26-16-18)28(25(31)24(21)30)10-4-9-27-11-13-32-14-12-27/h1-3,5-8,15-16,22,29H,4,9-14H2/b23-21+InChIKey
LTGUQXADUPIXLI-XTQSDGFTSA-NSynonyms
(E)1benzofuran2yl(1(3(morpholin4ium4yl)propyl)45dioxo2(pyridin3yl)pyrrolidin3ylidene)methanolate
MFCD18243617
O=C1C(=O)C(=C(c2cc3c(o2)cccc3)(O))C(N1CCC(NH+)1CCOCC1)c1cccnc1
ZINC000102498442
ZINC000102498452
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