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1-(4,6-DIMETHYLPYRIMIDIN-2-YL)-1'-(5-METHOXYBENZOTHIAZOL-2-YL)-3,3'-DIMETHYL-(4,5'-BIPYRAZOL)-5-OL
SpectraBase Compound ID DNx8Bchs0sU
InChI InChI=1S/C22H21N7O2S/c1-11-8-12(2)24-21(23-11)29-20(30)19(14(4)27-29)17-9-13(3)26-28(17)22-25-16-10-15(31-5)6-7-18(16)32-22/h6-10,30H,1-5H3
InChIKey GHQMXFLPNRMUDO-UHFFFAOYSA-N
Mol Weight 447.52 g/mol
Molecular Formula C22H21N7O2S
Exact Mass 447.147744 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EodnFavlWhO
Name 1-(4,6-DIMETHYLPYRIMIDIN-2-YL)-1'-(5-METHOXYBENZOTHIAZOL-2-YL)-3,3'-DIMETHYL-(4,5'-BIPYRAZOL)-5-OL
Compound Number 6G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H21N7O2S
InChI InChI=1S/C22H21N7O2S/c1-11-8-12(2)24-21(23-11)29-20(30)19(14(4)27-29)17-9-13(3)26-28(17)22-25-16-10-15(31-5)6-7-18(16)32-22/h6-10,30H,1-5H3
InChIKey GHQMXFLPNRMUDO-UHFFFAOYSA-N
Literature Reference Author R.AGGARWAL,C.RANI,C.SHARMA,K.R.ANEJA
Literature Reference Citation REP.ORG.CHEM.,3,13(2013)
Molecular Weight 447.514 g/mol
Sample ID 73300
Solvent CDCl3