Vitas-M small molecule compound
(E)-{1-[2-(diethylammonio)ethyl]-2-(2,3-dimethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}(4-ethoxyphenyl)methanolate
Catalog ID
STL045223
SMILES CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1OC)OC)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 C27H34N2O6 MW 482.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N2O6/c1-6-28(7-2)16-17-29-23(20-10-9-11-21(33-4)26(20)34-5)22(25(31)27(29)32)24(30)18-12-14-19(15-13-18)35-8-3/h9-15,23,30H,6-8,16-17H2,1-5H3/b24-22+InChIKey
AILSBEAJDSDZAU-ZNTNEXAZSA-NSynonyms
615278-95-0(4E)1(2DIETHYLAMINOETHYL)5(23DIMETHOXYPHENYL)4((4ETHOXYPHENYL)HYDROXYMETHYLIDENE)PYRROLIDINE23DIONE
(E)(1(2(diethylammonio)ethyl)2(23dimethoxyphenyl)45dioxopyrrolidin3ylidene)(4ethoxyphenyl)methanolate
(E)(1(2(DIETHYLAZANIUMYL)ETHYL)2(23DIMETHOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(4ETHOXYPHENYL)METHANOLATE
1(2(DIETHYLAMINO)ETHYL)5(23DIMETHOXYPHENYL)4((4ETHOXYPHENYL)CARBONYL)3HYDROXY3PYRROLIN2ONE
615278950
CC(NH+)(CC)CCN1C(C(=C(C2=CC=C(C=C2)OCC)(O))C(=O)C1=O)C3=C(C(=CC=C3)OC)OC
CCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1cccc(c1OC)OC)CC(NH+)(CC)CC)(O)
InChI=1SC27H34N2O6c1628(72)16172923(201091121(334)26(20)345)22(25(31)27(29)32)24(30)18121419(151318)3583h9152330H681617H215H3b2422+
MFCD18248594
ZINC000102876657
ZINC000102876658
Check stock
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Check stock on Vitas-MAvailable files
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