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5-[2-(4-CHLOROPHENYL)-4-OXO-1,3-THIAZOLIDIN-3-YL]-6-METHYL-1-PHENYL-1,5-DIHYDRO-4H-PYRAZOLO-[3,4-D]-PYRIMIDIN-4-ONE;ENOL-FORM

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5-[2-(4-CHLOROPHENYL)-4-OXO-1,3-THIAZOLIDIN-3-YL]-6-METHYL-1-PHENYL-1,5-DIHYDRO-4H-PYRAZOLO-[3,4-D]-PYRIMIDIN-4-ONE;ENOL-FORM
SpectraBase Compound ID KlHb4GbQzxb
InChI InChI=1S/C21H16ClN5O2S/c1-13-24-19-17(11-23-25(19)16-5-3-2-4-6-16)20(29)26(13)27-18(28)12-30-21(27)14-7-9-15(22)10-8-14/h2-12,21,28H,1H3
InChIKey ILKNQYOZDAHDEE-UHFFFAOYSA-N
Mol Weight 437.91 g/mol
Molecular Formula C21H16ClN5O2S
Exact Mass 437.071324 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KRpCyjJVsR3
Name 5-[2-(4-CHLOROPHENYL)-4-OXO-1,3-THIAZOLIDIN-3-YL]-6-METHYL-1-PHENYL-1,5-DIHYDRO-4H-PYRAZOLO-[3,4-D]-PYRIMIDIN-4-ONE;ENOL-FORM
Compound Number 8B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H16ClN5O2S
InChI InChI=1S/C21H16ClN5O2S/c1-13-24-19-17(11-23-25(19)16-5-3-2-4-6-16)20(29)26(13)27-18(28)12-30-21(27)14-7-9-15(22)10-8-14/h2-12,21,28H,1H3
InChIKey ILKNQYOZDAHDEE-UHFFFAOYSA-N
Literature Reference Author A.A.EL-TOMBARY
Literature Reference Citation SCI.PHARM.,81,393(2013)
Literature Reference DOI 10.3797/scipharm.1211-21
Molecular Weight 437.903 g/mol
Sample ID 73575
Solvent DMSO-D6