Vitas-M small molecule compound
(E)-{2-(4-ethoxy-3-methoxyphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(4-fluorophenyl)methanolate
Catalog ID
STL037932
SMILES CCOc1ccc(cc1OC)C1/C(=C(/c2ccc(cc2)F)\[O-])/C(=O)C(=O)N1CCC[NH+]1CCOCC1
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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 C27H31FN2O6 MW 498.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31FN2O6/c1-3-36-21-10-7-19(17-22(21)34-2)24-23(25(31)18-5-8-20(28)9-6-18)26(32)27(33)30(24)12-4-11-29-13-15-35-16-14-29/h5-10,17,24,31H,3-4,11-16H2,1-2H3/b25-23+InChIKey
VBKGBXNRCYXFBI-WJTDDFOZSA-NSynonyms
636990-23-3(4E)5(4ETHOXY3METHOXYPHENYL)4((4FLUOROPHENYL)HYDROXYMETHYLIDENE)1(3MORPHOLIN4YLPROPYL)PYRROLIDINE23DIONE
(E)(2(4ethoxy3methoxyphenyl)1(3(morpholin4ium4yl)propyl)45dioxopyrrolidin3ylidene)(4fluorophenyl)methanolate
(E)(2(4ETHOXY3METHOXYPHENYL)1(3MORPHOLIN4IUM4YLPROPYL)45DIOXOPYRROLIDIN3YLIDENE)(4FLUOROPHENYL)METHANOLATE
5(4ETHOXY3METHOXYPHENYL)4((4FLUOROPHENYL)CARBONYL)3HYDROXY1(3MORPHOLIN4YLPROPYL)3PYRROLIN2ONE
636990233
CCOC1=C(C=C(C=C1)C2C(=C(C3=CC=C(C=C3)F)O)C(=O)C(=O)N2CCCN4CCOCC4)OC
CCOc1ccc(cc1OC)C1C(=C(c2ccc(cc2)F)(O))C(=O)C(=O)N1CCC(NH+)1CCOCC1
InChI=1SC27H31FN2O6c13362110719(1722(21)342)2423(25(31)185820(28)9618)26(32)27(33)30(24)1241129131535161429h510172431H341116H212H3b2523+
MFCD18247522
ZINC000009123703
ZINC000009123704
Check stock
See real-time availability and sample size for STL037932 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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