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2-[(1-methyl-2-oxopropyl)sulfanyl]-3-phenyl-4(3H)-quinazolinone
SpectraBase Compound ID 5xkc1Csl1FL
InChI InChI=1S/C18H16N2O2S/c1-12(21)13(2)23-18-19-16-11-7-6-10-15(16)17(22)20(18)14-8-4-3-5-9-14/h3-11,13H,1-2H3
InChIKey KEGWXPYZJKWXBY-UHFFFAOYSA-N
Mol Weight 324.4 g/mol
Molecular Formula C18H16N2O2S
Exact Mass 324.093249 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HwvdrniQG41
Name 2-[(1-Methyl-2-oxopropyl)sulfanyl]-3-phenyl-4(3H)-quinazolinone
CAS Registry Number 298686-75-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16N2O2S
InChI InChI=1S/C18H16N2O2S/c1-12(21)13(2)23-18-19-16-11-7-6-10-15(16)17(22)20(18)14-8-4-3-5-9-14/h3-11,13H,1-2H3
InChIKey KEGWXPYZJKWXBY-UHFFFAOYSA-N
Molecular Weight 324.398 g/mol
SMILES c1ccc(N2C(=Nc3c(C2=O)cccc3)SC(C(=O)C)C)cc1
SPLASH splash10-0096-9561000000-fe7d1ad2555a80b474a2
Source of Spectrum AD-0-2532-0
Synonyms 2-(1-Methyl-2-oxo-propyl)sulfanyl-3-phenyl-quinazolin-4-one 2-(3-oxidanylidenebutan-2-ylsulfanyl)-3-phenyl-quinazolin-4-one 2-(3-oxobutan-2-ylsulfanyl)-3-phenylquinazolin-4-one 2-(3-oxobutan-2-ylthio)-3-phenyl-4-quinazolinone 2-[(2-keto-1-methyl-propyl)thio]-3-phenyl-quinazolin-4-one Quinazolin-4(3H)-one, 2-(1-methyl-2-oxopropylthio)-3-phenyl-
Wiley ID 1430581