Vitas-M small molecule compound
(E)-{2-(4-bromophenyl)-1-[2-(diethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(4-ethoxyphenyl)methanolate
Catalog ID
STK561332
SMILES CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)Br)CC[NH+](CC)CC)/[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 C25H29BrN2O4 MW 501.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29BrN2O4/c1-4-27(5-2)15-16-28-22(17-7-11-19(26)12-8-17)21(24(30)25(28)31)23(29)18-9-13-20(14-10-18)32-6-3/h7-14,22,29H,4-6,15-16H2,1-3H3/b23-21+InChIKey
SSECTRJYZHUEPD-XTQSDGFTSA-NSynonyms
204756-88-7(4E)5(4bromophenyl)1(2(diethylamino)ethyl)4((4ethoxyphenyl)hydroxymethylidene)pyrrolidine23dione
(4E)5(4BROMOPHENYL)1(2DIETHYLAMINOETHYL)4((4ETHOXYPHENYL)HYDROXYMETHYLIDENE)PYRROLIDINE23DIONE
(E)(2(4bromophenyl)1(2(diethylammonio)ethyl)45dioxopyrrolidin3ylidene)(4ethoxyphenyl)methanolate
(E)(2(4BROMOPHENYL)1(2(DIETHYLAZANIUMYL)ETHYL)45DIOXOPYRROLIDIN3YLIDENE)(4ETHOXYPHENYL)METHANOLATE
204756887
CCN(CC)CCN1C(C(=C(C2=CC=C(C=C2)OCC)O)C(=O)C1=O)C3=CC=C(C=C3)Br
CCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)Br)CC(NH+)(CC)CC)(O)
InChI=1SC25H29BrN2O4c1427(52)15162822(1771119(26)12817)21(24(30)25(28)31)23(29)1891320(141018)3263h7142229H461516H213H3b2321+
MFCD18243764
ZINC000102503117
ZINC000102503126
Check stock
See real-time availability and sample size for STK561332 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.