Vitas-M small molecule compound

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

Catalog ID
STK565127
SMILES C=CCOc1ccc(cc1)C1/C(=C(/c2ccccc2)\[O-])/C(=O)C(=O)N1CC[NH+](C)C

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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 C24H26N2O4 MW 406.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N2O4/c1-4-16-30-19-12-10-17(11-13-19)21-20(22(27)18-8-6-5-7-9-18)23(28)24(29)26(21)15-14-25(2)3/h4-13,21,27H,1,14-16H2,2-3H3/b22-20+
InChIKey
VDTFMOICOZBPAL-LSDHQDQOSA-N
Synonyms
618084-83-6
(4E)1(2DIMETHYLAMINOETHYL)4(HYDROXY(PHENYL)METHYLIDENE)5(4PROP2ENOXYPHENYL)PYRROLIDINE23DIONE
(4Z)1(2DIMETHYLAMINOETHYL)4(HYDROXY(PHENYL)METHYLIDENE)5(4PROP2ENOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(2(dimethylammonio)ethyl)45dioxo2(4(prop2en1yloxy)phenyl)pyrrolidin3ylidene)(phenyl)methanolate
(E)(1(2(DIMETHYLAZANIUMYL)ETHYL)45DIOXO2(4PROP2ENOXYPHENYL)PYRROLIDIN3YLIDENE)PHENYLMETHANOLATE
1(2(DIMETHYLAMINO)ETHYL)3HYDROXY4(PHENYLCARBONYL)5(4PROP2ENYLOXYPHENYL)3PYRROLIN2ONE
618084836
C(NH+)(C)CCN1C(C(=C(C2=CC=CC=C2)(O))C(=O)C1=O)C3=CC=C(C=C3)OCC=C
C=CCOc1ccc(cc1)C1C(=C(c2ccccc2)(O))C(=O)C(=O)N1CC(NH+)(C)C
InChI=1SC24H26N2O4c14163019121017(111319)2120(22(27)188657918)23(28)24(29)26(21)151425(2)3h4132127H11416H223H3b2220+
MFCD18244696
ZINC000006160685
ZINC000006160689

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Available files

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