Vitas-M small molecule compound

(E)-{1-[3-(dimethylammonio)propyl]-2-(4-methylphenyl)-4,5-dioxopyrrolidin-3-ylidene}(2,4-dimethyl-1,3-thiazol-5-yl)methanolate

Catalog ID
STL045886
SMILES Cc1ccc(cc1)C1N(CCC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1sc(nc1C)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 C22H27N3O3S MW 413.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N3O3S/c1-13-7-9-16(10-8-13)18-17(19(26)21-14(2)23-15(3)29-21)20(27)22(28)25(18)12-6-11-24(4)5/h7-10,18,26H,6,11-12H2,1-5H3/b19-17+
InChIKey
JJRFCWBXNLVLHY-HTXNQAPBSA-N
Synonyms

(E)(1(3(dimethylammonio)propyl)2(4methylphenyl)45dioxopyrrolidin3ylidene)(24dimethyl13thiazol5yl)methanolate
Cc1ccc(cc1)C1N(CCC(NH+)(C)C)C(=O)C(=O)C1=C(c1sc(nc1C)C)(O)
MFCD18248741
ZINC000006813170
ZINC000006813208

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Available files

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