Vitas-M small molecule compound

(E)-{2-(2-fluorophenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(7-methoxy-1-benzofuran-2-yl)methanolate

Catalog ID
STL148863
SMILES COc1cccc2c1oc(c2)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1F)CC[NH+]1CCOCC1)/[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 C26H25FN2O6 MW 480.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25FN2O6/c1-33-19-8-4-5-16-15-20(35-25(16)19)23(30)21-22(17-6-2-3-7-18(17)27)29(26(32)24(21)31)10-9-28-11-13-34-14-12-28/h2-8,15,22,30H,9-14H2,1H3/b23-21+
InChIKey
DKOQVLTYSGNXHJ-XTQSDGFTSA-N
Synonyms

(E)(2(2fluorophenyl)1(2(morpholin4ium4yl)ethyl)45dioxopyrrolidin3ylidene)(7methoxy1benzofuran2yl)methanolate
COc1cccc2c1oc(c2)C(=C1C(=O)C(=O)N(C1c1ccccc1F)CC(NH+)1CCOCC1)(O)
MFCD20755488
ZINC000102931742
ZINC000102931744

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Available files

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