Vitas-M small molecule compound
(E)-(4-butoxy-3-methylphenyl){2-(4-tert-butylphenyl)-1-[2-(diethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STK560244
SMILES CCCCOc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C(C)(C)C)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 C32H44N2O4 MW 520.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H44N2O4/c1-8-11-20-38-26-17-14-24(21-22(26)4)29(35)27-28(23-12-15-25(16-13-23)32(5,6)7)34(31(37)30(27)36)19-18-33(9-2)10-3/h12-17,21,28,35H,8-11,18-20H2,1-7H3/b29-27+InChIKey
HHQXFIRPTGKPHP-ORIPQNMZSA-NSynonyms
498534-73-9(4E)4((4butoxy3methylphenyl)hydroxymethylidene)5(4tertbutylphenyl)1(2(diethylamino)ethyl)pyrrolidine23dione
(4E)4((4BUTOXY3METHYLPHENYL)HYDROXYMETHYLIDENE)5(4TERTBUTYLPHENYL)1(2DIETHYLAMINOETHYL)PYRROLIDINE23DIONE
(E)(4butoxy3methylphenyl)(2(4tertbutylphenyl)1(2(diethylammonio)ethyl)45dioxopyrrolidin3ylidene)methanolate
(E)(4BUTOXY3METHYLPHENYL)(2(4TERTBUTYLPHENYL)1(2(DIETHYLAZANIUMYL)ETHYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
498534739
CCCCOC1=C(C=C(C=C1)C(=C2C(N(C(=O)C2=O)CCN(CC)CC)C3=CC=C(C=C3)C(C)(C)C)O)C
CCCCOc1ccc(cc1C)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)C(C)(C)C)CC(NH+)(CC)CC)(O)
InChI=1SC32H44N2O4c1811203826171424(2122(26)4)29(35)2728(23121525(161323)32(56)7)34(31(37)30(27)36)191833(92)103h1217212835H8111820H217H3b2927+
MFCD18243482
ZINC000102494261
ZINC000102494273
Check stock
See real-time availability and sample size for STK560244 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.