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1H-1,3,5-Triazepine-6,7-dione, 2,3-dihydro-2-(methylthio)-3-phenyl-2-(phenylamino)-
SpectraBase Compound ID 8nqGY2OgAQn
InChI InChI=1S/C17H16N4O2S/c1-24-17(19-13-8-4-2-5-9-13)20-16(23)15(22)18-12-21(17)14-10-6-3-7-11-14/h2-12,19H,1H3,(H,20,23)
InChIKey IUGQIWKMEMVBPG-UHFFFAOYSA-N
Mol Weight 340.4 g/mol
Molecular Formula C17H16N4O2S
Exact Mass 340.099397 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1BXXXtJfakz
Name 1H-1,3,5-Triazepine-6,7-dione, 2,3-dihydro-2-(methylthio)-3-phenyl-2-(phenylamino)-
CAS Registry Number 74793-07-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16N4O2S
InChI InChI=1S/C17H16N4O2S/c1-24-17(19-13-8-4-2-5-9-13)20-16(23)15(22)18-12-21(17)14-10-6-3-7-11-14/h2-12,19H,1H3,(H,20,23)
InChIKey IUGQIWKMEMVBPG-UHFFFAOYSA-N
Molecular Weight 340.401 g/mol
SMILES N1C(Nc2ccccc2)(N(C=NC(C1=O)=O)c1ccccc1)SC
SPLASH splash10-0005-9650000000-414a2c8c3b270ba9ba66
Source of Spectrum W5-30238-0-0
Synonyms 2-Anilino-2-(methylsulfanyl)-3-phenyl-2,3-dihydro-1H-1,3,5-triazepine-6,7-dione 2-Anilino-2-(methylthio)-3-phenyl-1H-1,3,5-triazepine-6,7-dione 2-Anilino-2-(methylthio)-3-phenyl-1H-1,3,5-triazepine-6,7-quinone 2-Anilino-2-methylsulfanyl-3-phenyl-1H-1,3,5-triazepine-6,7-dione 2-Methylsulfanyl-3-phenyl-2-phenylazanyl-1H-1,3,5-triazepine-6,7-dione
Wiley ID 1334990