Vitas-M small molecule compound

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

Catalog ID
STL038810
SMILES CCOc1ccc(cc1OC)C1/C(=C(/c2cccs2)\[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 C22H26N2O5S MW 430.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O5S/c1-5-29-15-9-8-14(13-16(15)28-4)19-18(20(25)17-7-6-12-30-17)21(26)22(27)24(19)11-10-23(2)3/h6-9,12-13,19,25H,5,10-11H2,1-4H3/b20-18+
InChIKey
BIFULKWLSFJNHG-CZIZESTLSA-N
Synonyms

(E)(1(2(dimethylammonio)ethyl)2(4ethoxy3methoxyphenyl)45dioxopyrrolidin3ylidene)(thiophen2yl)methanolate
CCOc1ccc(cc1OC)C1C(=C(c2cccs2)(O))C(=O)C(=O)N1CC(NH+)(C)C
MFCD18247707
ZINC000009008264
ZINC000009068943

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Available files

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