Vitas-M small molecule compound

(E)-{1-[3-(dimethylammonio)propyl]-2-(furan-2-yl)-4,5-dioxopyrrolidin-3-ylidene}[4-(prop-2-en-1-yloxy)phenyl]methanolate

Catalog ID
STK561939
SMILES C=CCOc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccco1)CCC[NH+](C)C)/[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 C23H26N2O5 MW 410.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N2O5/c1-4-14-29-17-10-8-16(9-11-17)21(26)19-20(18-7-5-15-30-18)25(23(28)22(19)27)13-6-12-24(2)3/h4-5,7-11,15,20,26H,1,6,12-14H2,2-3H3/b21-19+
InChIKey
DGOWRSKIBXWCKW-XUTLUUPISA-N
Synonyms
615271-54-0
(4E)1(3(DIMETHYLAMINO)PROPYL)5(FURAN2YL)4(HYDROXY(4PROP2ENOXYPHENYL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(1(3(dimethylammonio)propyl)2(furan2yl)45dioxopyrrolidin3ylidene)(4(prop2en1yloxy)phenyl)methanolate
(E)(1(3(DIMETHYLAZANIUMYL)PROPYL)2(FURAN2YL)45DIOXOPYRROLIDIN3YLIDENE)(4PROP2ENOXYPHENYL)METHANOLATE
1(3(DIMETHYLAMINO)PROPYL)5(2FURYL)3HYDROXY4((4PROP2ENYLOXYPHENYL)CARBONYL)3PYRROLIN2ONE
615271540
C=CCOc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccco1)CCC(NH+)(C)C)(O)
CN(C)CCCN1C(C(=C(C2=CC=C(C=C2)OCC=C)O)C(=O)C1=O)C3=CC=CO3
InChI=1SC23H26N2O5c1414291710816(91117)21(26)1920(1875153018)25(23(28)22(19)27)1361224(2)3h45711152026H161214H223H3b2119+
MFCD18243928
ZINC000006187663
ZINC000006187667

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Available files

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