Vitas-M small molecule compound
(E)-{1-[2-(dimethylammonio)ethyl]-2-(3-methoxy-4-propoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}(phenyl)methanolate
Catalog ID
STL045321
SMILES CCCOc1ccc(cc1OC)C1/C(=C(/c2ccccc2)\[O-])/C(=O)C(=O)N1CC[NH+](C)C
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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/c1-5-15-32-19-12-11-18(16-20(19)31-4)22-21(23(28)17-9-7-6-8-10-17)24(29)25(30)27(22)14-13-26(2)3/h6-12,16,22,28H,5,13-15H2,1-4H3/b23-21+InChIKey
TWSLEUPJDUCVJU-XTQSDGFTSA-NSynonyms
636988-88-0(4E)1(2DIMETHYLAMINOETHYL)4(HYDROXY(PHENYL)METHYLIDENE)5(3METHOXY4PROPOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(2(dimethylammonio)ethyl)2(3methoxy4propoxyphenyl)45dioxopyrrolidin3ylidene)(phenyl)methanolate
(E)(1(2(DIMETHYLAZANIUMYL)ETHYL)2(3METHOXY4PROPOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)PHENYLMETHANOLATE
1(2(DIMETHYLAMINO)ETHYL)3HYDROXY5(3METHOXY4PROPOXYPHENYL)4(PHENYLCARBONYL)3PYRROLIN2ONE
4BENZOYL1(2(DIMETHYLAMINO)ETHYL)3HYDROXY5(3METHOXY4PROPOXYPHENYL)15DIHYDRO2HPYRROL2ONE
636988880
CCCOC1=C(C=C(C=C1)C2C(=C(C3=CC=CC=C3)(O))C(=O)C(=O)N2CC(NH+)(C)C)OC
CCCOc1ccc(cc1OC)C1C(=C(c2ccccc2)(O))C(=O)C(=O)N1CC(NH+)(C)C
InChI=1SC25H30N2O5c15153219121118(1620(19)314)2221(23(28)1797681017)24(29)25(30)27(22)141326(2)3h612162228H51315H214H3b2321+
MFCD18248614
ZINC000008985738
ZINC000008985745
Check stock
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Check stock on Vitas-MAvailable files
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