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7-BENZYL-3-AMINO-2-PHENYLAMINO-5,6,7,8-TETRAHYDRO-3H-PYRIDO-[3',4':4,5]-THIENO-[2,3-D]-PYRIMIDIN-4-ONE
SpectraBase Compound ID IUZgKvseOHv
InChI InChI=1S/C22H21N5OS/c23-27-21(28)19-17-11-12-26(13-15-7-3-1-4-8-15)14-18(17)29-20(19)25-22(27)24-16-9-5-2-6-10-16/h1-10H,11-14,23H2,(H,24,25)
InChIKey DMXXJBZUAUUSMO-UHFFFAOYSA-N
Mol Weight 403.5 g/mol
Molecular Formula C22H21N5OS
Exact Mass 403.146681 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4SS6fhHtYIt
Name 7-BENZYL-3-AMINO-2-PHENYLAMINO-5,6,7,8-TETRAHYDRO-3H-PYRIDO-[3',4':4,5]-THIENO-[2,3-D]-PYRIMIDIN-4-ONE
Compound Number 28
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H21N5OS
InChI InChI=1S/C22H21N5OS/c23-27-21(28)19-17-11-12-26(13-15-7-3-1-4-8-15)14-18(17)29-20(19)25-22(27)24-16-9-5-2-6-10-16/h1-10H,11-14,23H2,(H,24,25)
InChIKey DMXXJBZUAUUSMO-UHFFFAOYSA-N
Literature Reference Author K.M.AL-TAISAN,H.M.A.AL-HAZIMI,S.S.AL-SHIHRY
Literature Reference Citation MOLECULES,15,3932(2010)
Literature Reference DOI 10.3390/molecules15063932
Molecular Weight 403.502 g/mol
Sample ID 70971
Solvent CDCl3