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5-ISOPROPYL-6-(1-NAPHTHYLMETHYL)-2-[(THIOPHEN-2-YL)-THIO]-PYRIMIDIN-4(3H)-ONE
SpectraBase Compound ID 23SwWF61jFJ
InChI InChI=1S/C22H20N2OS2/c1-14(2)20-18(13-16-9-5-8-15-7-3-4-10-17(15)16)23-22(24-21(20)25)27-19-11-6-12-26-19/h3-12,14H,13H2,1-2H3,(H,23,24,25)
InChIKey FUESMRSEZOMFOY-UHFFFAOYSA-N
Mol Weight 392.54 g/mol
Molecular Formula C22H20N2OS2
Exact Mass 392.101706 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C6d53qveKUd
Name 5-ISOPROPYL-6-(1-NAPHTHYLMETHYL)-2-[(THIOPHEN-2-YL)-THIO]-PYRIMIDIN-4(3H)-ONE
Compound Number 2V
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H20N2OS2
InChI InChI=1S/C22H20N2OS2/c1-14(2)20-18(13-16-9-5-8-15-7-3-4-10-17(15)16)23-22(24-21(20)25)27-19-11-6-12-26-19/h3-12,14H,13H2,1-2H3,(H,23,24,25)
InChIKey FUESMRSEZOMFOY-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 392.534 g/mol
Sample ID 39902
Solvent DMSO-D6