Vitas-M small molecule compound
(E)-{1-[2-(diethylammonio)ethyl]-2-(3,4-dimethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}(4-methylphenyl)methanolate
Catalog ID
STK573291
SMILES CC[NH+](CCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)C)/[O-])/C1c1ccc(c(c1)OC)OC)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 C26H32N2O5 MW 452.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H32N2O5/c1-6-27(7-2)14-15-28-23(19-12-13-20(32-4)21(16-19)33-5)22(25(30)26(28)31)24(29)18-10-8-17(3)9-11-18/h8-13,16,23,29H,6-7,14-15H2,1-5H3/b24-22+InChIKey
PBCAHSRPHQZWCZ-ZNTNEXAZSA-NSynonyms
497247-42-4(4E)1(2DIETHYLAMINOETHYL)5(34DIMETHOXYPHENYL)4(HYDROXY(4METHYLPHENYL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(1(2(diethylammonio)ethyl)2(34dimethoxyphenyl)45dioxopyrrolidin3ylidene)(4methylphenyl)methanolate
(E)(1(2(DIETHYLAZANIUMYL)ETHYL)2(34DIMETHOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(4METHYLPHENYL)METHANOLATE
497247424
CC(NH+)(CC)CCN1C(C(=C(C2=CC=C(C=C2)C)(O))C(=O)C1=O)C3=CC(=C(C=C3)OC)OC
CC(NH+)(CCN1C(=O)C(=O)C(=C(c2ccc(cc2)C)(O))C1c1ccc(c(c1)OC)OC)CC
InChI=1SC26H32N2O5c1627(72)14152823(19121320(324)21(1619)335)22(25(30)26(28)31)24(29)1810817(3)91118h813162329H671415H215H3b2422+
MFCD18245470
ZINC000102571569
ZINC000102571578
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.