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2-(4-(4-BROMOPHENYLSULFONYL)-PHENYL)-5-(4-FLUOROBENZYLIDENE)-THIAZOLO-[3,2-B]-[1,2,4]-TRIAZOL-6(5H)-ONE
SpectraBase Compound ID GxtODGPojyx
InChI InChI=1S/C23H13BrFN3O3S2/c24-16-5-11-19(12-6-16)33(30,31)18-9-3-15(4-10-18)21-26-23-28(27-21)22(29)20(32-23)13-14-1-7-17(25)8-2-14/h1-13H/b20-13-
InChIKey SFICKLFPAKKRQA-MOSHPQCFSA-N
Mol Weight 542.4 g/mol
Molecular Formula C23H13BrFN3O3S2
Exact Mass 540.956575 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B8BOe3WOMwR
Name 2-(4-(4-BROMOPHENYLSULFONYL)-PHENYL)-5-(4-FLUOROBENZYLIDENE)-THIAZOLO-[3,2-B]-[1,2,4]-TRIAZOL-6(5H)-ONE
Compound Number 4C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H13BrFN3O3S2
InChI InChI=1S/C23H13BrFN3O3S2/c24-16-5-11-19(12-6-16)33(30,31)18-9-3-15(4-10-18)21-26-23-28(27-21)22(29)20(32-23)13-14-1-7-17(25)8-2-14/h1-13H/b20-13-
InChIKey SFICKLFPAKKRQA-MOSHPQCFSA-N
Literature Reference Author S.F.BARBUCEANU,C.DRAGHICI,F.BARBUCEANU,G.BANCESCU,G.SARAMET
Literature Reference Citation CHEM.PHARM.BULL.,63,694(2015)
Literature Reference DOI 10.1248/cpb.c15-00379
Molecular Weight 542.397 g/mol
Solvent CDCl3:TFA
Source File Reference UWPA10121