Vitas-M small molecule compound

(E)-{2-(3,4-dichlorophenyl)-1-[2-(diethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(4-fluorophenyl)methanolate

Catalog ID
STL045846
SMILES CC[NH+](CCN1C(c2ccc(c(c2)Cl)Cl)/C(=C(/c2ccc(cc2)F)\[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 C23H23Cl2FN2O3 MW 465.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23Cl2FN2O3/c1-3-27(4-2)11-12-28-20(15-7-10-17(24)18(25)13-15)19(22(30)23(28)31)21(29)14-5-8-16(26)9-6-14/h5-10,13,20,29H,3-4,11-12H2,1-2H3/b21-19+
InChIKey
LPEPJVRQLACXSF-XUTLUUPISA-N
Synonyms
615272-01-0
(4E)5(34dichlorophenyl)1(2(diethylamino)ethyl)4((4fluorophenyl)hydroxymethylidene)pyrrolidine23dione
(4E)5(34DICHLOROPHENYL)1(2DIETHYLAMINOETHYL)4((4FLUOROPHENYL)HYDROXYMETHYLIDENE)PYRROLIDINE23DIONE
(E)(2(34dichlorophenyl)1(2(diethylammonio)ethyl)45dioxopyrrolidin3ylidene)(4fluorophenyl)methanolate
(E)(2(34DICHLOROPHENYL)1(2(DIETHYLAZANIUMYL)ETHYL)45DIOXOPYRROLIDIN3YLIDENE)(4FLUOROPHENYL)METHANOLATE
5(34DICHLOROPHENYL)1(2(DIETHYLAMINO)ETHYL)4((4FLUOROPHENYL)CARBONYL)3HYDROXY3PYRROLIN2ONE
5(34DICHLOROPHENYL)1(2(DIETHYLAMINO)ETHYL)4(4FLUOROBENZOYL)3HYDROXY15DIHYDRO2HPYRROL2ONE
615272010
CC(NH+)(CCN1C(c2ccc(c(c2)Cl)Cl)C(=C(c2ccc(cc2)F)(O))C(=O)C1=O)CC
CCN(CC)CCN1C(C(=C(C2=CC=C(C=C2)F)O)C(=O)C1=O)C3=CC(=C(C=C3)Cl)Cl
InChI=1SC23H23Cl2FN2O3c1327(42)11122820(1571017(24)18(25)1315)19(22(30)23(28)31)21(29)145816(26)9614h510132029H341112H212H3b2119+
MFCD18248725
ZINC000009007558
ZINC000009008702

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Available files

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