Vitas-M small molecule compound
(E)-{1-[3-(dimethylammonio)propyl]-2-(3-methoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}(4-ethoxyphenyl)methanolate
Catalog ID
STK559720
SMILES CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)OC)CCC[NH+](C)C)/[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 C25H30N2O5 MW 438.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N2O5/c1-5-32-19-12-10-17(11-13-19)23(28)21-22(18-8-6-9-20(16-18)31-4)27(25(30)24(21)29)15-7-14-26(2)3/h6,8-13,16,22,28H,5,7,14-15H2,1-4H3/b23-21+InChIKey
SRSROXUFCLRZTH-XTQSDGFTSA-NSynonyms
371117-98-5(4E)1(3(DIMETHYLAMINO)PROPYL)4((4ETHOXYPHENYL)HYDROXYMETHYLIDENE)5(3METHOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(3(dimethylammonio)propyl)2(3methoxyphenyl)45dioxopyrrolidin3ylidene)(4ethoxyphenyl)methanolate
(E)(1(3(DIMETHYLAZANIUMYL)PROPYL)2(3METHOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(4ETHOXYPHENYL)METHANOLATE
1(3(DIMETHYLAMINO)PROPYL)4((4ETHOXYPHENYL)CARBONYL)3HYDROXY5(3METHOXYPHENYL)3PYRROLIN2ONE
371117985
CCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCCN(C)C)C3=CC(=CC=C3)OC)O
CCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1cccc(c1)OC)CCC(NH+)(C)C)(O)
InChI=1SC25H30N2O5c153219121017(111319)23(28)2122(1886920(1618)314)27(25(30)24(21)29)1571426(2)3h6813162228H571415H214H3b2321+
MFCD18243346
ZINC000102489709
ZINC000102489719
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.