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5-(4-CHLOROPHENYL)-6-CYANO-3,7-DIMETHYL-2-METHYLSULFANYL-5,8-DIHYDROPYRIDO-[2,3-D]-PYRIMIDIN-4(3H)-ONE
SpectraBase Compound ID 6RCbSWW7fJI
InChI InChI=1S/C17H15ClN4OS/c1-9-12(8-19)13(10-4-6-11(18)7-5-10)14-15(20-9)21-17(24-3)22(2)16(14)23/h4-7,13,20H,1-3H3
InChIKey NHTIJLXZBAJAKI-UHFFFAOYSA-N
Mol Weight 358.85 g/mol
Molecular Formula C17H15ClN4OS
Exact Mass 358.06551 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4exXCkW9CoZ
Name 5-(4-CHLOROPHENYL)-6-CYANO-3,7-DIMETHYL-2-METHYLSULFANYL-5,8-DIHYDROPYRIDO-[2,3-D]-PYRIMIDIN-4(3H)-ONE
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H15ClN4OS
InChI InChI=1S/C17H15ClN4OS/c1-9-12(8-19)13(10-4-6-11(18)7-5-10)14-15(20-9)21-17(24-3)22(2)16(14)23/h4-7,13,20H,1-3H3
InChIKey NHTIJLXZBAJAKI-UHFFFAOYSA-N
Literature Reference Author J.QUIROGA,C.CISNEROS,B.INSUASTY,R.ABONIA,S.CRUZ,M.NOGUERAS,J .M.DELATORRE,M.SORTI
Literature Reference Citation J.HETCYCL.CHEM.,43,299(2006)
Literature Reference DOI 10.1002/jhet.5570430208
Molecular Weight 358.845 g/mol
Sample ID 67226
Solvent DMSO-D6