Vitas-M small molecule compound
(E)-(4-fluorophenyl){2-(furan-2-yl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STK564905
SMILES Fc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccco1)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 C21H21FN2O5 MW 400.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21FN2O5/c22-15-5-3-14(4-6-15)19(25)17-18(16-2-1-11-29-16)24(21(27)20(17)26)8-7-23-9-12-28-13-10-23/h1-6,11,18,25H,7-10,12-13H2/b19-17+InChIKey
QTMNNPVARYYRKD-HTXNQAPBSA-NSynonyms
(4E)4((4FLUOROPHENYL)HYDROXYMETHYLIDENE)5(FURAN2YL)1(2MORPHOLIN4YLETHYL)PYRROLIDINE23DIONE
(E)(4fluorophenyl)(2(furan2yl)1(2(morpholin4ium4yl)ethyl)45dioxopyrrolidin3ylidene)methanolate
(E)(4FLUOROPHENYL)(2(FURAN2YL)1(2MORPHOLIN4IUM4YLETHYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
C1COCCN1CCN2C(C(=C(C3=CC=C(C=C3)F)O)C(=O)C2=O)C4=CC=CO4
Fc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccco1)CC(NH+)1CCOCC1)(O)
InChI=1SC21H21FN2O5c22155314(4615)19(25)1718(1621112916)24(21(27)20(17)26)872391228131023h16111825H7101213H2b1917+
MFCD18244646
ZINC000004427325
ZINC000102531325
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