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4-(1,5-DIMETHYL-3-OXO-2-PHENYL-2,3-DIHYDRO-1H-PYRAZOL-4-YL-AMINO)-6-(PARA-FLUOROPHENYL)-2-THIOXO-1,2-DIHYDROPYRIMIDINE-5-CARBONITRILE

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4-(1,5-DIMETHYL-3-OXO-2-PHENYL-2,3-DIHYDRO-1H-PYRAZOL-4-YL-AMINO)-6-(PARA-FLUOROPHENYL)-2-THIOXO-1,2-DIHYDROPYRIMIDINE-5-CARBONITRILE
SpectraBase Compound ID 6rfnzrb4N86
InChI InChI=1S/C22H17FN6OS/c1-13-18(21(30)29(28(13)2)16-6-4-3-5-7-16)25-20-17(12-24)19(26-22(31)27-20)14-8-10-15(23)11-9-14/h3-11H,1-2H3,(H2,25,26,27,31)
InChIKey XLYARNLEFYBGFT-UHFFFAOYSA-N
Mol Weight 432.48 g/mol
Molecular Formula C22H17FN6OS
Exact Mass 432.116859 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5li3HVxRPPZ
Name 4-(1,5-DIMETHYL-3-OXO-2-PHENYL-2,3-DIHYDRO-1H-PYRAZOL-4-YL-AMINO)-6-(PARA-FLUOROPHENYL)-2-THIOXO-1,2-DIHYDROPYRIMIDINE-5-CARBONITRILE
Compound Number 9A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H17FN6OS
InChI InChI=1S/C22H17FN6OS/c1-13-18(21(30)29(28(13)2)16-6-4-3-5-7-16)25-20-17(12-24)19(26-22(31)27-20)14-8-10-15(23)11-9-14/h3-11H,1-2H3,(H2,25,26,27,31)
InChIKey XLYARNLEFYBGFT-UHFFFAOYSA-N
Literature Reference Author M.S.MOHAMED,A.M.AWAD,N.M.AHMED
Literature Reference Citation ACTA.PHARM.,61,171(2011)
Molecular Weight 432.475 g/mol
Solvent Unknown
Source File Reference UWLU78975