Vitas-M small molecule compound
(E)-{2-[4-(diethylamino)phenyl]-1-[2-(dimethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(4-fluorophenyl)methanolate
Catalog ID
STL039084
SMILES CCN(c1ccc(cc1)C1/C(=C(/c2ccc(cc2)F)\[O-])/C(=O)C(=O)N1CC[NH+](C)C)CC
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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 C25H30FN3O3 MW 439.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30FN3O3/c1-5-28(6-2)20-13-9-17(10-14-20)22-21(23(30)18-7-11-19(26)12-8-18)24(31)25(32)29(22)16-15-27(3)4/h7-14,22,30H,5-6,15-16H2,1-4H3/b23-21+InChIKey
MAPGDLJVZSPIOG-XTQSDGFTSA-NSynonyms
462069-90-5(4E)5(4(DIETHYLAMINO)PHENYL)1(2DIMETHYLAMINOETHYL)4((4FLUOROPHENYL)HYDROXYMETHYLIDENE)PYRROLIDINE23DIONE
(E)(2(4(diethylamino)phenyl)1(2(dimethylammonio)ethyl)45dioxopyrrolidin3ylidene)(4fluorophenyl)methanolate
(E)(2(4(DIETHYLAMINO)PHENYL)1(2(DIMETHYLAZANIUMYL)ETHYL)45DIOXOPYRROLIDIN3YLIDENE)(4FLUOROPHENYL)METHANOLATE
462069905
CCN(c1ccc(cc1)C1C(=C(c2ccc(cc2)F)(O))C(=O)C(=O)N1CC(NH+)(C)C)CC
CCN(CC)C1=CC=C(C=C1)C2C(=C(C3=CC=C(C=C3)F)(O))C(=O)C(=O)N2CC(NH+)(C)C
InChI=1SC25H30FN3O3c1528(62)2013917(101420)2221(23(30)1871119(26)12818)24(31)25(32)29(22)161527(3)4h7142230H561516H214H3b2321+
MFCD18247767
ZINC000009234272
ZINC000009234278
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.