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4-[4-[[4-CHLORO-3-(TRIFLUOROMETHY)-PHENYL]-CARBAMOYLAMINO]-PHENOXY]-N-CYCLOPENTYL-PYRIDINE-2-CARBOXAMIDE

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4-[4-[[4-CHLORO-3-(TRIFLUOROMETHY)-PHENYL]-CARBAMOYLAMINO]-PHENOXY]-N-CYCLOPENTYL-PYRIDINE-2-CARBOXAMIDE
SpectraBase Compound ID HFhXe9SZ33V
InChI InChI=1S/C25H22ClF3N4O3/c26-21-10-7-17(13-20(21)25(27,28)29)33-24(35)32-16-5-8-18(9-6-16)36-19-11-12-30-22(14-19)23(34)31-15-3-1-2-4-15/h5-15H,1-4H2,(H,31,34)(H2,32,33,35)
InChIKey XAWBOEGQDBWRRK-UHFFFAOYSA-N
Mol Weight 518.92 g/mol
Molecular Formula C25H22ClF3N4O3
Exact Mass 518.133253 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B3yqnQwuPck
Name 4-[4-[[4-CHLORO-3-(TRIFLUOROMETHY)-PHENYL]-CARBAMOYLAMINO]-PHENOXY]-N-CYCLOPENTYL-PYRIDINE-2-CARBOXAMIDE
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H22ClF3N4O3
InChI InChI=1S/C25H22ClF3N4O3/c26-21-10-7-17(13-20(21)25(27,28)29)33-24(35)32-16-5-8-18(9-6-16)36-19-11-12-30-22(14-19)23(34)31-15-3-1-2-4-15/h5-15H,1-4H2,(H,31,34)(H2,32,33,35)
InChIKey XAWBOEGQDBWRRK-UHFFFAOYSA-N
Literature Reference Author Z.BABIC,M.CRKVENCIC,Z.RAJIC,A.M.MIKECIN,M.KRALJ,J.BALZARINI, M.PETROVA,J.VANDERLE
Literature Reference Citation MOLECULES,17,1124(2012)
Literature Reference DOI 10.3390/molecules17011124
Molecular Weight 518.923 g/mol
Sample ID 73091
Solvent DMSO-D6