Vitas-M small molecule compound

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

Catalog ID
STK560675
SMILES CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccco1)CC[NH+](CC)CC)/[O-]

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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 C23H28N2O5 MW 412.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N2O5/c1-4-24(5-2)13-14-25-20(18-8-7-15-30-18)19(22(27)23(25)28)21(26)16-9-11-17(12-10-16)29-6-3/h7-12,15,20,26H,4-6,13-14H2,1-3H3/b21-19+
InChIKey
BDGWZPQWKZKSAL-XUTLUUPISA-N
Synonyms

(4E)1(2DIETHYLAMINOETHYL)4((4ETHOXYPHENYL)HYDROXYMETHYLIDENE)5(FURAN2YL)PYRROLIDINE23DIONE
(E)(1(2(diethylammonio)ethyl)2(furan2yl)45dioxopyrrolidin3ylidene)(4ethoxyphenyl)methanolate
(E)(1(2(DIETHYLAZANIUMYL)ETHYL)2(FURAN2YL)45DIOXOPYRROLIDIN3YLIDENE)(4ETHOXYPHENYL)METHANOLATE
1(2(DIETHYLAMINO)ETHYL)4((4ETHOXYPHENYL)CARBONYL)5(2FURYL)3HYDROXY3PYRROLIN2ONE
CC(NH+)(CC)CCN1C(C(=C(C2=CC=C(C=C2)OCC)(O))C(=O)C1=O)C3=CC=CO3
CCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccco1)CC(NH+)(CC)CC)(O)
InChI=1SC23H28N2O5c1424(52)13142520(1887153018)19(22(27)23(25)28)21(26)1691117(121016)2963h712152026H461314H213H3b2119+
MFCD18243598
ZINC000102497943
ZINC000102497953

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Available files

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