Vitas-M small molecule compound
(E)-{1-[3-(dimethylammonio)propyl]-2-(2-fluorophenyl)-4,5-dioxopyrrolidin-3-ylidene}(4-fluorophenyl)methanolate
Catalog ID
STK558908
SMILES Fc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1F)CCC[NH+](C)C)/[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 C22H22F2N2O3 MW 400.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22F2N2O3/c1-25(2)12-5-13-26-19(16-6-3-4-7-17(16)24)18(21(28)22(26)29)20(27)14-8-10-15(23)11-9-14/h3-4,6-11,19,27H,5,12-13H2,1-2H3/b20-18+InChIKey
FRNFTWIFOHVCJQ-CZIZESTLSA-NSynonyms
(4E)1(3(DIMETHYLAMINO)PROPYL)5(2FLUOROPHENYL)4((4FLUOROPHENYL)HYDROXYMETHYLIDENE)PYRROLIDINE23DIONE
(E)(1(3(dimethylammonio)propyl)2(2fluorophenyl)45dioxopyrrolidin3ylidene)(4fluorophenyl)methanolate
(E)(1(3(DIMETHYLAZANIUMYL)PROPYL)2(2FLUOROPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(4FLUOROPHENYL)METHANOLATE
C(NH+)(C)CCCN1C(C(=C(C2=CC=C(C=C2)F)(O))C(=O)C1=O)C3=CC=CC=C3F
Fc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccccc1F)CCC(NH+)(C)C)(O)
InChI=1SC22H22F2N2O3c125(2)125132619(16634717(16)24)18(21(28)22(26)29)20(27)1481015(23)11914h346111927H51213H212H3b2018+
MFCD18243139
ZINC000006198490
ZINC000006198503
Check stock
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Check stock on Vitas-MAvailable files
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