Vitas-M small molecule compound
(E)-2,3-dihydro-1,4-benzodioxin-6-yl{1-[3-(dimethylammonio)propyl]-2-(2-fluorophenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STL148910
SMILES C[NH+](CCCN1C(=O)C(=O)/C(=C(\c2ccc3c(c2)OCCO3)/[O-])/C1c1ccccc1F)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 C24H25FN2O5 MW 440.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25FN2O5/c1-26(2)10-5-11-27-21(16-6-3-4-7-17(16)25)20(23(29)24(27)30)22(28)15-8-9-18-19(14-15)32-13-12-31-18/h3-4,6-9,14,21,28H,5,10-13H2,1-2H3/b22-20+InChIKey
RMORMTKEIGBYTO-LSDHQDQOSA-NSynonyms
618405-59-7(4E)4(23DIHYDRO14BENZODIOXIN6YL(HYDROXY)METHYLIDENE)1(3(DIMETHYLAMINO)PROPYL)5(2FLUOROPHENYL)PYRROLIDINE23DIONE
(E)23dihydro14benzodioxin6yl(1(3(dimethylammonio)propyl)2(2fluorophenyl)45dioxopyrrolidin3ylidene)methanolate
(E)23DIHYDRO14BENZODIOXIN6YL(1(3(DIMETHYLAZANIUMYL)PROPYL)2(2FLUOROPHENYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
618405597
C(NH+)(C)CCCN1C(C(=C(C2=CC3=C(C=C2)OCCO3)(O))C(=O)C1=O)C4=CC=CC=C4F
C(NH+)(CCCN1C(=O)C(=O)C(=C(c2ccc3c(c2)OCCO3)(O))C1c1ccccc1F)C
InChI=1SC24H25FN2O5c126(2)105112721(16634717(16)25)20(23(29)24(27)30)22(28)15891819(1415)3213123118h3469142128H51013H212H3b2220+
MFCD20755497
ZINC000009312005
ZINC000009312006
Check stock
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Check stock on Vitas-MAvailable files
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