Vitas-M small molecule compound
(E)-{2-(3,4-diethoxyphenyl)-1-[3-(diethylammonio)propyl]-4,5-dioxopyrrolidin-3-ylidene}(phenyl)methanolate
Catalog ID
STL047406
SMILES CCOc1cc(ccc1OCC)C1/C(=C(/c2ccccc2)\[O-])/C(=O)C(=O)N1CCC[NH+](CC)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 C28H36N2O5 MW 480.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H36N2O5/c1-5-29(6-2)17-12-18-30-25(21-15-16-22(34-7-3)23(19-21)35-8-4)24(27(32)28(30)33)26(31)20-13-10-9-11-14-20/h9-11,13-16,19,25,31H,5-8,12,17-18H2,1-4H3/b26-24+InChIKey
SKXDYESZQZZGAD-SHHOIMCASA-NSynonyms
620132-66-3(4E)5(34DIETHOXYPHENYL)1(3(DIETHYLAMINO)PROPYL)4(HYDROXY(PHENYL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(2(34diethoxyphenyl)1(3(diethylammonio)propyl)45dioxopyrrolidin3ylidene)(phenyl)methanolate
(E)(2(34DIETHOXYPHENYL)1(3(DIETHYLAZANIUMYL)PROPYL)45DIOXOPYRROLIDIN3YLIDENE)PHENYLMETHANOLATE
620132663
CC(NH+)(CC)CCCN1C(C(=C(C2=CC=CC=C2)(O))C(=O)C1=O)C3=CC(=C(C=C3)OCC)OCC
CCOc1cc(ccc1OCC)C1C(=C(c2ccccc2)(O))C(=O)C(=O)N1CCC(NH+)(CC)CC
InChI=1SC28H36N2O5c1529(62)1712183025(21151622(3473)23(1921)3584)24(27(32)28(30)33)26(31)2013109111420h9111316192531H58121718H214H3b2624+
MFCD18249063
ZINC000102882959
ZINC000102882964
Check stock
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