Vitas-M small molecule compound
(E)-{1-[3-(diethylammonio)propyl]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-3-ylidene}(2,4-dimethyl-1,3-thiazol-5-yl)methanolate
Catalog ID
STL150307
SMILES CC[NH+](CCCN1C(=O)C(=O)/C(=C(\c2sc(nc2C)C)/[O-])/C1c1ccc(cc1)[N+](=O)[O-])CC
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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 C23H28N4O5S MW 472.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N4O5S/c1-5-25(6-2)12-7-13-26-19(16-8-10-17(11-9-16)27(31)32)18(21(29)23(26)30)20(28)22-14(3)24-15(4)33-22/h8-11,19,28H,5-7,12-13H2,1-4H3/b20-18+InChIKey
AHMBHHKFOZZYPW-CZIZESTLSA-NSynonyms
(E)(1(3(diethylammonio)propyl)2(4nitrophenyl)45dioxopyrrolidin3ylidene)(24dimethyl13thiazol5yl)methanolate
CC(NH+)(CCCN1C(=O)C(=O)C(=C(c2sc(nc2C)C)(O))C1c1ccc(cc1)(N+)(=O)(O))CC
MFCD20755799
ZINC000008919322
ZINC000008919330
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