Vitas-M small molecule compound
(E)-{1-[2-(diethylammonio)ethyl]-4,5-dioxo-2-phenylpyrrolidin-3-ylidene}(7-methoxy-1-benzofuran-2-yl)methanolate
Catalog ID
STL147518
SMILES COc1cccc2c1oc(c2)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1)CC[NH+](CC)CC)/[O-]
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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 C26H28N2O5 MW 448.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N2O5/c1-4-27(5-2)14-15-28-22(17-10-7-6-8-11-17)21(24(30)26(28)31)23(29)20-16-18-12-9-13-19(32-3)25(18)33-20/h6-13,16,22,29H,4-5,14-15H2,1-3H3/b23-21+InChIKey
BKZXOIHVPIXECV-XTQSDGFTSA-NSynonyms
(E)(1(2(diethylammonio)ethyl)45dioxo2phenylpyrrolidin3ylidene)(7methoxy1benzofuran2yl)methanolate
COc1cccc2c1oc(c2)C(=C1C(=O)C(=O)N(C1c1ccccc1)CC(NH+)(CC)CC)(O)
MFCD20755210
ZINC000009275787
ZINC000009275790
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