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6-CYANO-5-(4-METHOXYPHENYL)-3-METHYL-2-METHYLSULFANYL-7-PHENYL-5,8-DIHYDROPYRIDO-[2,3-D]-PYRIMIDIN-4(3H)-ONE
SpectraBase Compound ID F3QRJUZ1AZW
InChI InChI=1S/C23H20N4O2S/c1-27-22(28)19-18(14-9-11-16(29-2)12-10-14)17(13-24)20(15-7-5-4-6-8-15)25-21(19)26-23(27)30-3/h4-12,18,25H,1-3H3
InChIKey SOTKNIKOBGKINN-UHFFFAOYSA-N
Mol Weight 416.5 g/mol
Molecular Formula C23H20N4O2S
Exact Mass 416.130697 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C4wkWkdkWtx
Name 6-CYANO-5-(4-METHOXYPHENYL)-3-METHYL-2-METHYLSULFANYL-7-PHENYL-5,8-DIHYDROPYRIDO-[2,3-D]-PYRIMIDIN-4(3H)-ONE
Compound Number 5Q
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H20N4O2S
InChI InChI=1S/C23H20N4O2S/c1-27-22(28)19-18(14-9-11-16(29-2)12-10-14)17(13-24)20(15-7-5-4-6-8-15)25-21(19)26-23(27)30-3/h4-12,18,25H,1-3H3
InChIKey SOTKNIKOBGKINN-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 416.497 g/mol
Sample ID 67242
Solvent DMSO-D6