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2-[(Phenacylmethyl)thio]-5-ethyl-6.alpha.-naphthylthio pyrimidin-4(3H)-one
SpectraBase Compound ID 6kg0eAdMLeS
InChI InChI=1S/C24H20N2O2S2/c1-2-18-22(28)25-24(29-15-20(27)17-10-4-3-5-11-17)26-23(18)30-21-14-8-12-16-9-6-7-13-19(16)21/h3-14H,2,15H2,1H3,(H,25,26,28)
InChIKey SJUPTBVXEJFKME-UHFFFAOYSA-N
Mol Weight 432.56 g/mol
Molecular Formula C24H20N2O2S2
Exact Mass 432.09662 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1KfH7gVvpL2
Name 2-[(Phenacylmethyl)thio]-5-ethyl-6.alpha.-naphthylthio pyrimidin-4(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H20N2O2S2
InChI InChI=1S/C24H20N2O2S2/c1-2-18-22(28)25-24(29-15-20(27)17-10-4-3-5-11-17)26-23(18)30-21-14-8-12-16-9-6-7-13-19(16)21/h3-14H,2,15H2,1H3,(H,25,26,28)
InChIKey SJUPTBVXEJFKME-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.200400961
Molecular Weight 432.556 g/mol
SMILES N1C(C(=C(N=C1SCC(c1ccccc1)=O)Sc1c2c(cccc2)ccc1)CC)=O
SPLASH splash10-0bvi-0609200000-96aa9c7d2e9760f998a9
Source of Spectrum APC-338-460-5a
Synonyms 5-Ethyl-6-(naphthalen-1-ylthio)-2-((2-oxo-2-phenylethyl)thio)pyrimidin-4(3H)-one 5-Ethyl-4-(1-naphthalenylthio)-2-(phenacylthio)-1H-pyrimidin-6-one 5-Ethyl-4-(1-naphthylsulfanyl)-2-phenacylsulfanyl-1H-pyrimidin-6-one 5-Ethyl-4-naphthalen-1-ylsulfanyl-2-phenacylsulfanyl-1H-pyrimidin-6-one
Wiley ID 1768632