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6-(4-CHLOROBENZYL)-5-ETHYL-2-[3-(N-PHTHALIMIDO)-PROPYL]-THIOPYRIMIDIN-4(3H)-ONE
SpectraBase Compound ID LfO4PY5My18
InChI InChI=1S/C24H22ClN3O3S/c1-2-17-20(14-15-8-10-16(25)11-9-15)26-24(27-21(17)29)32-13-5-12-28-22(30)18-6-3-4-7-19(18)23(28)31/h3-4,6-11H,2,5,12-14H2,1H3,(H,26,27,29)
InChIKey KJJTZTIVYXQVTA-UHFFFAOYSA-N
Mol Weight 467.97 g/mol
Molecular Formula C24H22ClN3O3S
Exact Mass 467.10704 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FBo4pfU3QeO
Name 6-(4-CHLOROBENZYL)-5-ETHYL-2-[3-(N-PHTHALIMIDO)-PROPYL]-THIOPYRIMIDIN-4(3H)-ONE
Compound Number 7D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H22ClN3O3S
InChI InChI=1S/C24H22ClN3O3S/c1-2-17-20(14-15-8-10-16(25)11-9-15)26-24(27-21(17)29)32-13-5-12-28-22(30)18-6-3-4-7-19(18)23(28)31/h3-4,6-11H,2,5,12-14H2,1H3,(H,26,27,29)
InChIKey KJJTZTIVYXQVTA-UHFFFAOYSA-N
Literature Reference Author M.I.ATTIA,A.A.EL-EMAM,A.A.AL-TURKISTANI,A.L.KANSOH,N.R.EL-BR OLLOSY
Literature Reference Citation MOLECULES,19,279(2014)
Literature Reference DOI 10.3390/molecules19010279
Molecular Weight 467.970 g/mol
Solvent DMSO-D6
Source File Reference UWBT14583