Vitas-M small molecule compound

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

Catalog ID
STK563303
SMILES CC[NH+](CCN1C(c2cccnc2)/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 C22H24ClN3O3 MW 413.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24ClN3O3/c1-3-25(4-2)12-13-26-19(16-6-5-11-24-14-16)18(21(28)22(26)29)20(27)15-7-9-17(23)10-8-15/h5-11,14,19,27H,3-4,12-13H2,1-2H3/b20-18+
InChIKey
NAWCHYGPAKNFFV-CZIZESTLSA-N
Synonyms

(4E)4((4CHLOROPHENYL)HYDROXYMETHYLIDENE)1(2DIETHYLAMINOETHYL)5PYRIDIN3YLPYRROLIDINE23DIONE
(E)(4chlorophenyl)(1(2(diethylammonio)ethyl)45dioxo2(pyridin3yl)pyrrolidin3ylidene)methanolate
(E)(4CHLOROPHENYL)(1(2(DIETHYLAZANIUMYL)ETHYL)45DIOXO2PYRIDIN3YLPYRROLIDIN3YLIDENE)METHANOLATE
1(2(DIETHYLAMINO)ETHYL)4((4CHLOROPHENYL)CARBONYL)3HYDROXY5(3PYRIDYL)3PYRROLIN2ONE
CC(NH+)(CC)CCN1C(C(=C(C2=CC=C(C=C2)Cl)(O))C(=O)C1=O)C3=CN=CC=C3
CC(NH+)(CCN1C(c2cccnc2)C(=C(c2ccc(cc2)Cl)(O))C(=O)C1=O)CC
InChI=1SC22H24ClN3O3c1325(42)12132619(166511241416)18(21(28)22(26)29)20(27)157917(23)10815h511141927H341213H212H3b2018+
MFCD18244262
ZINC000005564206
ZINC000005564221

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Available files

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