Vitas-M small molecule compound
(E)-{2-(2,5-dimethoxyphenyl)-1-[3-(dimethylammonio)propyl]-4,5-dioxopyrrolidin-3-ylidene}(2,4-dimethyl-1,3-thiazol-5-yl)methanolate
Catalog ID
STK565217
SMILES COc1ccc(c(c1)C1N(CCC[NH+](C)C)C(=O)C(=O)/C/1=C(\c1sc(nc1C)C)/[O-])OC
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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 C23H29N3O5S MW 459.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N3O5S/c1-13-22(32-14(2)24-13)20(27)18-19(16-12-15(30-5)8-9-17(16)31-6)26(23(29)21(18)28)11-7-10-25(3)4/h8-9,12,19,27H,7,10-11H2,1-6H3/b20-18+InChIKey
XNGYFZKVICOKIS-CZIZESTLSA-NSynonyms
(E)(2(25dimethoxyphenyl)1(3(dimethylammonio)propyl)45dioxopyrrolidin3ylidene)(24dimethyl13thiazol5yl)methanolate
COc1ccc(c(c1)C1N(CCC(NH+)(C)C)C(=O)C(=O)C1=C(c1sc(nc1C)C)(O))OC
MFCD18244721
ZINC000102533394
ZINC000102533398
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