Vitas-M small molecule compound
(E)-{2-(2-fluorophenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(thiophen-2-yl)methanolate
Catalog ID
STK559412
SMILES O=C1C(=O)/C(=C(\c2cccs2)/[O-])/C(N1CCC[NH+]1CCOCC1)c1ccccc1F
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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 C22H23FN2O4S MW 430.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23FN2O4S/c23-16-6-2-1-5-15(16)19-18(20(26)17-7-3-14-30-17)21(27)22(28)25(19)9-4-8-24-10-12-29-13-11-24/h1-3,5-7,14,19,26H,4,8-13H2/b20-18+InChIKey
BJIIULZZOCNIRH-CZIZESTLSA-NSynonyms
(E)(2(2fluorophenyl)1(3(morpholin4ium4yl)propyl)45dioxopyrrolidin3ylidene)(thiophen2yl)methanolate
MFCD18243260
O=C1C(=O)C(=C(c2cccs2)(O))C(N1CCC(NH+)1CCOCC1)c1ccccc1F
ZINC000009045264
ZINC000102486903
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