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N-(5-acetyl-6-methylsulfanyl-2-phenyl-pyrimidin-4-yl)benzamide
SpectraBase Compound ID L50S0WJm2Vy
InChI InChI=1S/C20H17N3O2S/c1-13(24)16-18(22-19(25)15-11-7-4-8-12-15)21-17(23-20(16)26-2)14-9-5-3-6-10-14/h3-12H,1-2H3,(H,21,22,23,25)
InChIKey AFGDAVUKFOYTEH-UHFFFAOYSA-N
Mol Weight 363.44 g/mol
Molecular Formula C20H17N3O2S
Exact Mass 363.104148 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HWv1PsmI8aC
Name N-(5-acetyl-6-methylsulfanyl-2-phenyl-pyrimidin-4-yl)benzamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H17N3O2S
InChI InChI=1S/C20H17N3O2S/c1-13(24)16-18(22-19(25)15-11-7-4-8-12-15)21-17(23-20(16)26-2)14-9-5-3-6-10-14/h3-12H,1-2H3,(H,21,22,23,25)
InChIKey AFGDAVUKFOYTEH-UHFFFAOYSA-N
Molecular Weight 363.435 g/mol
SMILES N(c1nc(-c2ccccc2)nc(c1C(=O)C)SC)C(=O)c1ccccc1
SPLASH splash10-0002-0009000000-34cff0f6439bf0f67d3b
Source of Spectrum F9-1993-1936-5
Synonyms N-(5-ethanoyl-6-methylsulfanyl-2-phenyl-pyrimidin-4-yl)benzamide N-[5-acetyl-6-(methylthio)-2-phenyl-4-pyrimidinyl]benzamide N-[5-acetyl-6-(methylthio)-2-phenyl-pyrimidin-4-yl]benzamide
Wiley ID 1566825