Vitas-M small molecule compound

(E)-{1-[3-(dimethylammonio)propyl]-2-(5-methylfuran-2-yl)-4,5-dioxopyrrolidin-3-ylidene}(phenyl)methanolate

Catalog ID
STK561914
SMILES Cc1ccc(o1)C1/C(=C(/c2ccccc2)\[O-])/C(=O)C(=O)N1CCC[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 C21H24N2O4 MW 368.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O4/c1-14-10-11-16(27-14)18-17(19(24)15-8-5-4-6-9-15)20(25)21(26)23(18)13-7-12-22(2)3/h4-6,8-11,18,24H,7,12-13H2,1-3H3/b19-17+
InChIKey
PXRNKTNOZLYXEO-HTXNQAPBSA-N
Synonyms
378765-25-4
(4E)1(3(DIMETHYLAMINO)PROPYL)4(HYDROXY(PHENYL)METHYLIDENE)5(5METHYLFURAN2YL)PYRROLIDINE23DIONE
(E)(1(3(dimethylammonio)propyl)2(5methylfuran2yl)45dioxopyrrolidin3ylidene)(phenyl)methanolate
(E)(1(3(DIMETHYLAZANIUMYL)PROPYL)2(5METHYLFURAN2YL)45DIOXOPYRROLIDIN3YLIDENE)PHENYLMETHANOLATE
378765254
CC1=CC=C(O1)C2C(=C(C3=CC=CC=C3)O)C(=O)C(=O)N2CCCN(C)C
Cc1ccc(o1)C1C(=C(c2ccccc2)(O))C(=O)C(=O)N1CCC(NH+)(C)C
InChI=1SC21H24N2O4c114101116(2714)1817(19(24)158546915)20(25)21(26)23(18)1371222(2)3h468111824H71213H213H3b1917+
MFCD18243926
ZINC000004312053
ZINC000004312054

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Available files

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