Vitas-M small molecule compound
(E)-{4,5-dioxo-2-[3-(prop-2-en-1-yloxy)phenyl]-1-(pyridinium-3-ylmethyl)pyrrolidin-3-ylidene}(4-fluorophenyl)methanolate
Catalog ID
STL039731
SMILES C=CCOc1cccc(c1)C1/C(=C(/c2ccc(cc2)F)\[O-])/C(=O)C(=O)N1Cc1ccc[nH+]c1
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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 C26H21FN2O4 MW 444.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21FN2O4/c1-2-13-33-21-7-3-6-19(14-21)23-22(24(30)18-8-10-20(27)11-9-18)25(31)26(32)29(23)16-17-5-4-12-28-15-17/h2-12,14-15,23,30H,1,13,16H2/b24-22+InChIKey
FQWBYJNUMQTGMI-ZNTNEXAZSA-NSynonyms
620143-47-7(4E)4((4FLUOROPHENYL)HYDROXYMETHYLIDENE)5(3PROP2ENOXYPHENYL)1(PYRIDIN3YLMETHYL)PYRROLIDINE23DIONE
(E)(45dioxo2(3(prop2en1yloxy)phenyl)1(pyridinium3ylmethyl)pyrrolidin3ylidene)(4fluorophenyl)methanolate
(E)(45DIOXO2(3PROP2ENOXYPHENYL)1(PYRIDIN1IUM3YLMETHYL)PYRROLIDIN3YLIDENE)(4FLUOROPHENYL)METHANOLATE
620143477
C=CCOC1=CC=CC(=C1)C2C(=C(C3=CC=C(C=C3)F)(O))C(=O)C(=O)N2CC4=C(NH+)=CC=C4
C=CCOc1cccc(c1)C1C(=C(c2ccc(cc2)F)(O))C(=O)C(=O)N1Cc1ccc(nH+)c1
InChI=1SC26H21FN2O4c1213332173619(1421)2322(24(30)1881020(27)11918)25(31)26(32)29(23)16175412281517h21214152330H11316H2b2422+
MFCD18247891
ZINC000101313424
ZINC000101313428
Check stock
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