Vitas-M small molecule compound

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

Catalog ID
STK561817
SMILES CC[NH+](CCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)OC)/[O-])/C1c1cccnc1)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 C23H27N3O4 MW 409.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3O4/c1-4-25(5-2)13-14-26-20(17-7-6-12-24-15-17)19(22(28)23(26)29)21(27)16-8-10-18(30-3)11-9-16/h6-12,15,20,27H,4-5,13-14H2,1-3H3/b21-19+
InChIKey
QWNGOHGYZFXKCL-XUTLUUPISA-N
Synonyms
615275-14-4
(4E)1(2DIETHYLAMINOETHYL)4(HYDROXY(4METHOXYPHENYL)METHYLIDENE)5PYRIDIN3YLPYRROLIDINE23DIONE
(4Z)1(2DIETHYLAMINOETHYL)4(HYDROXY(4METHOXYPHENYL)METHYLIDENE)5PYRIDIN3YLPYRROLIDINE23DIONE
(E)(1(2(diethylammonio)ethyl)45dioxo2(pyridin3yl)pyrrolidin3ylidene)(4methoxyphenyl)methanolate
(E)(1(2(DIETHYLAZANIUMYL)ETHYL)45DIOXO2PYRIDIN3YLPYRROLIDIN3YLIDENE)(4METHOXYPHENYL)METHANOLATE
1(2(DIETHYLAMINO)ETHYL)3HYDROXY4((4METHOXYPHENYL)CARBONYL)5(3PYRIDYL)3PYRROLIN2ONE
615275144
CC(NH+)(CC)CCN1C(C(=C(C2=CC=C(C=C2)OC)(O))C(=O)C1=O)C3=CN=CC=C3
CC(NH+)(CCN1C(=O)C(=O)C(=C(c2ccc(cc2)OC)(O))C1c1cccnc1)CC
InChI=1SC23H27N3O4c1425(52)13142620(177612241517)19(22(28)23(26)29)21(27)1681018(303)11916h612152027H451314H213H3b2119+
MFCD18243899
ZINC000005799458
ZINC000005799481

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Available files

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