Vitas-M small molecule compound

(E)-{1-[2-(diethylammonio)ethyl]-4,5-dioxo-2-[4-(prop-2-en-1-yloxy)phenyl]pyrrolidin-3-ylidene}(4-ethoxyphenyl)methanolate

Catalog ID
STK562789
SMILES C=CCOc1ccc(cc1)C1/C(=C(/c2ccc(cc2)OCC)\[O-])/C(=O)C(=O)N1CC[NH+](CC)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 C28H34N2O5 MW 478.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H34N2O5/c1-5-19-35-23-13-9-20(10-14-23)25-24(26(31)21-11-15-22(16-12-21)34-8-4)27(32)28(33)30(25)18-17-29(6-2)7-3/h5,9-16,25,31H,1,6-8,17-19H2,2-4H3/b26-24+
InChIKey
POEPHFRNFFLLKT-SHHOIMCASA-N
Synonyms
618087-83-5
(4E)1(2(diethylamino)ethyl)4((4ethoxyphenyl)hydroxymethylidene)5(4prop2enoxyphenyl)pyrrolidine23dione
(4E)1(2DIETHYLAMINOETHYL)4((4ETHOXYPHENYL)HYDROXYMETHYLIDENE)5(4PROP2ENOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(2(diethylammonio)ethyl)45dioxo2(4(prop2en1yloxy)phenyl)pyrrolidin3ylidene)(4ethoxyphenyl)methanolate
(E)(1(2(DIETHYLAZANIUMYL)ETHYL)45DIOXO2(4PROP2ENOXYPHENYL)PYRROLIDIN3YLIDENE)(4ETHOXYPHENYL)METHANOLATE
1(2(DIETHYLAMINO)ETHYL)4((4ETHOXYPHENYL)CARBONYL)3HYDROXY5(4PROP2ENYLOXYPHENYL)3PYRROLIN2ONE
618087835
C=CCOc1ccc(cc1)C1C(=C(c2ccc(cc2)OCC)(O))C(=O)C(=O)N1CC(NH+)(CC)CC
CCN(CC)CCN1C(C(=C(C2=CC=C(C=C2)OCC)O)C(=O)C1=O)C3=CC=C(C=C3)OCC=C
InChI=1SC28H34N2O5c1519352313920(101423)2524(26(31)21111522(161221)3484)27(32)28(33)30(25)181729(62)73h59162531H1681719H224H3b2624+
MFCD18244129
ZINC000009070520
ZINC000009070526

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Available files

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