Vitas-M small molecule compound

(E)-(4-chlorophenyl){1-[2-(diethylammonio)ethyl]-2-(5-methylfuran-2-yl)-4,5-dioxopyrrolidin-3-ylidene}methanolate

Catalog ID
STK560950
SMILES CC[NH+](CCN1C(c2ccc(o2)C)/C(=C(/c2ccc(cc2)Cl)\[O-])/C(=O)C1=O)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 C22H25ClN2O4 MW 416.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25ClN2O4/c1-4-24(5-2)12-13-25-19(17-11-6-14(3)29-17)18(21(27)22(25)28)20(26)15-7-9-16(23)10-8-15/h6-11,19,26H,4-5,12-13H2,1-3H3/b20-18+
InChIKey
PSECANMZWVVVCU-CZIZESTLSA-N
Synonyms
615272-68-9
(4E)4((4chlorophenyl)hydroxymethylidene)1(2(diethylamino)ethyl)5(5methylfuran2yl)pyrrolidine23dione
(4E)4((4CHLOROPHENYL)HYDROXYMETHYLIDENE)1(2DIETHYLAMINOETHYL)5(5METHYLFURAN2YL)PYRROLIDINE23DIONE
(E)(4chlorophenyl)(1(2(diethylammonio)ethyl)2(5methylfuran2yl)45dioxopyrrolidin3ylidene)methanolate
(E)(4CHLOROPHENYL)(1(2(DIETHYLAZANIUMYL)ETHYL)2(5METHYLFURAN2YL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
1(2(DIETHYLAMINO)ETHYL)4((4CHLOROPHENYL)CARBONYL)3HYDROXY5(5METHYL(2FURYL))3PYRROLIN2ONE
4(4CHLOROBENZOYL)1(2(DIETHYLAMINO)ETHYL)3HYDROXY5(5METHYL2FURYL)15DIHYDRO2HPYRROL2ONE
615272689
CC(NH+)(CCN1C(c2ccc(o2)C)C(=C(c2ccc(cc2)Cl)(O))C(=O)C1=O)CC
CCN(CC)CCN1C(C(=C(C2=CC=C(C=C2)Cl)O)C(=O)C1=O)C3=CC=C(O3)C
InChI=1SC22H25ClN2O4c1424(52)12132519(1711614(3)2917)18(21(27)22(25)28)20(26)157916(23)10815h6111926H451213H213H3b2018+
MFCD18243671
ZINC000005488645
ZINC000006294608

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Available files

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