Vitas-M small molecule compound
(E)-{1-[3-(dimethylammonio)propyl]-2-(4-methoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}(4-fluorophenyl)methanolate
Catalog ID
STK559858
SMILES COc1ccc(cc1)C1/C(=C(/c2ccc(cc2)F)\[O-])/C(=O)C(=O)N1CCC[NH+](C)C
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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 C23H25FN2O4 MW 412.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25FN2O4/c1-25(2)13-4-14-26-20(15-7-11-18(30-3)12-8-15)19(22(28)23(26)29)21(27)16-5-9-17(24)10-6-16/h5-12,20,27H,4,13-14H2,1-3H3/b21-19+InChIKey
DGIAPAGFYAPFEH-XUTLUUPISA-NSynonyms
380880-78-4(4E)1(3(DIMETHYLAMINO)PROPYL)4((4FLUOROPHENYL)HYDROXYMETHYLIDENE)5(4METHOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(3(dimethylammonio)propyl)2(4methoxyphenyl)45dioxopyrrolidin3ylidene)(4fluorophenyl)methanolate
(E)(1(3(DIMETHYLAZANIUMYL)PROPYL)2(4METHOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(4FLUOROPHENYL)METHANOLATE
380880784
C(NH+)(C)CCCN1C(C(=C(C2=CC=C(C=C2)F)(O))C(=O)C1=O)C3=CC=C(C=C3)OC
COc1ccc(cc1)C1C(=C(c2ccc(cc2)F)(O))C(=O)C(=O)N1CCC(NH+)(C)C
InChI=1SC23H25FN2O4c125(2)134142620(1571118(303)12815)19(22(28)23(26)29)21(27)165917(24)10616h5122027H41314H213H3b2119+
MFCD18243387
ZINC000102490990
ZINC000102491001
Check stock
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Check stock on Vitas-MAvailable files
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