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5-Bromo-4-([4-(2-naphthyloxy)butyl]sulfanyl)-2(1H)-pyrimidinone
SpectraBase Compound ID K5zybgXNRmJ
InChI InChI=1S/C18H17BrN2O2S/c19-16-12-20-18(22)21-17(16)24-10-4-3-9-23-15-8-7-13-5-1-2-6-14(13)11-15/h1-2,5-8,11-12H,3-4,9-10H2,(H,20,21,22)
InChIKey NRROOJCVXZCHDG-UHFFFAOYSA-N
Mol Weight 405.31 g/mol
Molecular Formula C18H17BrN2O2S
Exact Mass 404.019412 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LQ2ePxK79OM
Name 5-Bromo-4-([4-(2-naphthyloxy)butyl]sulfanyl)-2(1H)-pyrimidinone
CAS Registry Number 118365-22-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17BrN2O2S
InChI InChI=1S/C18H17BrN2O2S/c19-16-12-20-18(22)21-17(16)24-10-4-3-9-23-15-8-7-13-5-1-2-6-14(13)11-15/h1-2,5-8,11-12H,3-4,9-10H2,(H,20,21,22)
InChIKey NRROOJCVXZCHDG-UHFFFAOYSA-N
Molecular Weight 405.310 g/mol
SMILES N1C(N=CC(=C1SCCCCOc1ccc2ccccc2c1)Br)=O
SPLASH splash10-03di-0690100000-7eadd4d942dde5d75e33
Source of Spectrum O-23-484-29
Synonyms 5-Bromanyl-6-(4-naphthalen-2-yloxybutylsulfanyl)-1H-pyrimidin-2-one 5-Bromo-6-(4-naphthalen-2-yloxybutylsulfanyl)-1H-pyrimidin-2-one 5-Bromo-6-[4-(2-naphthalenyloxy)butylthio]-1H-pyrimidin-2-one 5-Bromo-6-[4-(2-naphthoxy)butylthio]-1H-pyrimidin-2-one 5-Bromo-6-[4-(2-naphthyloxy)butylsulfanyl]-1H-pyrimidin-2-one
Wiley ID 1371096