Vitas-M small molecule compound
(E)-{1-[3-(diethylammonio)propyl]-2-(4-fluorophenyl)-4,5-dioxopyrrolidin-3-ylidene}(2,4-dimethyl-1,3-thiazol-5-yl)methanolate
Catalog ID
STK560482
SMILES CC[NH+](CCCN1C(c2ccc(cc2)F)/C(=C(/c2sc(nc2C)C)\[O-])/C(=O)C1=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 C23H28FN3O3S MW 445.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28FN3O3S/c1-5-26(6-2)12-7-13-27-19(16-8-10-17(24)11-9-16)18(21(29)23(27)30)20(28)22-14(3)25-15(4)31-22/h8-11,19,28H,5-7,12-13H2,1-4H3/b20-18+InChIKey
VUBVYMIXDCTQCN-CZIZESTLSA-NSynonyms
(E)(1(3(diethylammonio)propyl)2(4fluorophenyl)45dioxopyrrolidin3ylidene)(24dimethyl13thiazol5yl)methanolate
CC(NH+)(CCCN1C(c2ccc(cc2)F)C(=C(c2sc(nc2C)C)(O))C(=O)C1=O)CC
MFCD18243548
ZINC000009270810
ZINC000009270812
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