Vitas-M small molecule compound

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

Catalog ID
STK564285
SMILES CC[NH+](CCN1C(=O)C(=O)/C(=C(\c2ccncc2)/[O-])/C1c1ccc(cc1)Br)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 C22H24BrN3O3 MW 458.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24BrN3O3/c1-3-25(4-2)13-14-26-19(15-5-7-17(23)8-6-15)18(21(28)22(26)29)20(27)16-9-11-24-12-10-16/h5-12,19,27H,3-4,13-14H2,1-2H3/b20-18+
InChIKey
ULARRXBDNLETMU-CZIZESTLSA-N
Synonyms
627476-66-8
(4E)5(4BROMOPHENYL)1(2DIETHYLAMINOETHYL)4(HYDROXY(PYRIDIN4YL)METHYLIDENE)PYRROLIDINE23DIONE
(4Z)5(4BROMOPHENYL)1(2DIETHYLAMINOETHYL)4(HYDROXY(PYRIDIN4YL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(2(4bromophenyl)1(2(diethylammonio)ethyl)45dioxopyrrolidin3ylidene)(pyridin4yl)methanolate
(E)(2(4BROMOPHENYL)1(2(DIETHYLAZANIUMYL)ETHYL)45DIOXOPYRROLIDIN3YLIDENE)PYRIDIN4YLMETHANOLATE
1(2(DIETHYLAMINO)ETHYL)5(4BROMOPHENYL)3HYDROXY4(4PYRIDYLCARBONYL)3PYRROLIN2ONE
627476668
CC(NH+)(CC)CCN1C(C(=C(C2=CC=NC=C2)(O))C(=O)C1=O)C3=CC=C(C=C3)Br
CC(NH+)(CCN1C(=O)C(=O)C(=C(c2ccncc2)(O))C1c1ccc(cc1)Br)CC
InChI=1SC22H24BrN3O3c1325(42)13142619(155717(23)8615)18(21(28)22(26)29)20(27)1691124121016h5121927H341314H212H3b2018+
MFCD18244501
ZINC000009008793
ZINC000009008794

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Available files

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