John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=GjPns4zrD2r SpectraBase Spectrum ID=2uwRnlj6lvE

(accessed ).
ALPHA-(4-METHYLTHIO-1-PHENYLPYRAZOLO-[3,4-D]-PYRIMIDIN-6-YLTHIO)-N-BUTYL-PROPANAMIDE
SpectraBase Compound ID GjPns4zrD2r
InChI InChI=1S/C19H23N5OS2/c1-4-5-11-20-17(25)13(2)27-19-22-16-15(18(23-19)26-3)12-21-24(16)14-9-7-6-8-10-14/h6-10,12-13H,4-5,11H2,1-3H3,(H,20,25)
InChIKey LPYQKRXEQFUJBO-UHFFFAOYSA-N
Mol Weight 401.55 g/mol
Molecular Formula C19H23N5OS2
Exact Mass 401.134404 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2uwRnlj6lvE
Name ALPHA-(4-METHYLTHIO-1-PHENYLPYRAZOLO-[3,4-D]-PYRIMIDIN-6-YLTHIO)-N-BUTYL-PROPANAMIDE
Compound Number 6D
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H23N5OS2
InChI InChI=1S/C19H23N5OS2/c1-4-5-11-20-17(25)13(2)27-19-22-16-15(18(23-19)26-3)12-21-24(16)14-9-7-6-8-10-14/h6-10,12-13H,4-5,11H2,1-3H3,(H,20,25)
InChIKey LPYQKRXEQFUJBO-UHFFFAOYSA-N
Literature Reference Author M.CHEBIB,D.MCKEVENEY,R.J.QUINN
Literature Reference Citation BIOORG.MED.CHEM.,8,2581(2000)
Literature Reference DOI 10.1016/S0968-0896(00)00190-5
Molecular Weight 401.545 g/mol
Solvent DMSO-D6
Source File Reference UWVN20468
SpectraBase Batch ID 1UvcZQT46cE