Vitas-M small molecule compound
(E)-1-benzofuran-2-yl{1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxo-2-[4-(propan-2-yl)phenyl]pyrrolidin-3-ylidene}methanolate
Catalog ID
STK559689
SMILES O=C1C(=O)/C(=C(\c2cc3c(o2)cccc3)/[O-])/C(N1CC[NH+]1CCOCC1)c1ccc(cc1)C(C)C
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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 C28H30N2O5 MW 474.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N2O5/c1-18(2)19-7-9-20(10-8-19)25-24(26(31)23-17-21-5-3-4-6-22(21)35-23)27(32)28(33)30(25)12-11-29-13-15-34-16-14-29/h3-10,17-18,25,31H,11-16H2,1-2H3/b26-24+InChIKey
UXLHBSPTFWFNAM-SHHOIMCASA-NSynonyms
(E)1benzofuran2yl(1(2(morpholin4ium4yl)ethyl)45dioxo2(4(propan2yl)phenyl)pyrrolidin3ylidene)methanolate
MFCD18243336
O=C1C(=O)C(=C(c2cc3c(o2)cccc3)(O))C(N1CC(NH+)1CCOCC1)c1ccc(cc1)C(C)C
ZINC000009046711
ZINC000009046712
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