Vitas-M small molecule compound
(E)-{2-(3,4-dichlorophenyl)-1-[3-(dimethylammonio)propyl]-4,5-dioxopyrrolidin-3-ylidene}(2,4-dimethyl-1,3-thiazol-5-yl)methanolate
Catalog ID
STL045392
SMILES Cc1sc(c(n1)C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(c(c1)Cl)Cl)CCC[NH+](C)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 C21H23Cl2N3O3S MW 468.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23Cl2N3O3S/c1-11-20(30-12(2)24-11)18(27)16-17(13-6-7-14(22)15(23)10-13)26(21(29)19(16)28)9-5-8-25(3)4/h6-7,10,17,27H,5,8-9H2,1-4H3/b18-16+InChIKey
IRZVPDZWHCJUOI-FBMGVBCBSA-NSynonyms
(E)(2(34dichlorophenyl)1(3(dimethylammonio)propyl)45dioxopyrrolidin3ylidene)(24dimethyl13thiazol5yl)methanolate
Cc1sc(c(n1)C)C(=C1C(=O)C(=O)N(C1c1ccc(c(c1)Cl)Cl)CCC(NH+)(C)C)(O)
MFCD18248628
ZINC000102878674
ZINC000102878676
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