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5-METHYL-6-(1-NAPHTHYLMETHYL)-2-[(THIOPHEN-2-YL)-THIO]-PYRIMIDIN-4(3H)-ONE
SpectraBase Compound ID 7RuuN34upow
InChI InChI=1S/C20H16N2OS2/c1-13-17(12-15-8-4-7-14-6-2-3-9-16(14)15)21-20(22-19(13)23)25-18-10-5-11-24-18/h2-11H,12H2,1H3,(H,21,22,23)
InChIKey RJWIELNYDSIEGQ-UHFFFAOYSA-N
Mol Weight 364.48 g/mol
Molecular Formula C20H16N2OS2
Exact Mass 364.070405 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GaT3vya0sOt
Name 5-METHYL-6-(1-NAPHTHYLMETHYL)-2-[(THIOPHEN-2-YL)-THIO]-PYRIMIDIN-4(3H)-ONE
Compound Number 2T
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H16N2OS2
InChI InChI=1S/C20H16N2OS2/c1-13-17(12-15-8-4-7-14-6-2-3-9-16(14)15)21-20(22-19(13)23)25-18-10-5-11-24-18/h2-11H,12H2,1H3,(H,21,22,23)
InChIKey RJWIELNYDSIEGQ-UHFFFAOYSA-N
Literature Reference Author Z.K.RAO,J.LONG,C.LI,S.S.ZHANG,M.HE,L.C.OU,Y.T.ZHENG,Y.P.HE
Literature Reference Citation MH.CHEM.,139,967(2008)
Literature Reference DOI 10.1007/s00706-007-0834-8
Molecular Weight 364.480 g/mol
Sample ID 39900
Solvent DMSO-D6