Vitas-M small molecule compound

(E)-(3,4-dimethoxyphenyl){1-[2-(dimethylammonio)ethyl]-2-(4-methoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate

Catalog ID
STL045045
SMILES COc1ccc(cc1)C1N(CC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1ccc(c(c1)OC)OC)/[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 C24H28N2O6 MW 440.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N2O6/c1-25(2)12-13-26-21(15-6-9-17(30-3)10-7-15)20(23(28)24(26)29)22(27)16-8-11-18(31-4)19(14-16)32-5/h6-11,14,21,27H,12-13H2,1-5H3/b22-20+
InChIKey
LCTBXBZCYRJTMU-LSDHQDQOSA-N
Synonyms
615272-17-8
(4E)4((34DIMETHOXYPHENYL)HYDROXYMETHYLIDENE)1(2DIMETHYLAMINOETHYL)5(4METHOXYPHENYL)PYRROLIDINE23DIONE
(E)(34dimethoxyphenyl)(1(2(dimethylammonio)ethyl)2(4methoxyphenyl)45dioxopyrrolidin3ylidene)methanolate
(E)(34DIMETHOXYPHENYL)(1(2(DIMETHYLAZANIUMYL)ETHYL)2(4METHOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
4((34DIMETHOXYPHENYL)CARBONYL)1(2(DIMETHYLAMINO)ETHYL)3HYDROXY5(4METHOXYPHENYL)3PYRROLIN2ONE
615272178
C(NH+)(C)CCN1C(C(=C(C2=CC(=C(C=C2)OC)OC)(O))C(=O)C1=O)C3=CC=C(C=C3)OC
COc1ccc(cc1)C1N(CC(NH+)(C)C)C(=O)C(=O)C1=C(c1ccc(c(c1)OC)OC)(O)
InChI=1SC24H28N2O6c125(2)12132621(156917(303)10715)20(23(28)24(26)29)22(27)1681118(314)19(1416)325h611142127H1213H215H3b2220+
MFCD18248548
ZINC000008903313
ZINC000102876862

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Available files

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