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2-Phenyl-4,8-di-tolyl-4,8-dihydro-1H-imidazo[4,5-d][1,3,6]thiadiazepine-5,7-dithione
SpectraBase Compound ID 5KnrLjeOccO
InChI InChI=1S/C25H20N4S3/c1-16-8-12-19(13-9-16)28-22-23(27-21(26-22)18-6-4-3-5-7-18)29(25(31)32-24(28)30)20-14-10-17(2)11-15-20/h3-15H,1-2H3,(H,26,27)
InChIKey QTEJZIUNAZKTNC-UHFFFAOYSA-N
Mol Weight 472.64 g/mol
Molecular Formula C25H20N4S3
Exact Mass 472.08501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 49fG5W5pwKO
Name 2-Phenyl-4,8-di-tolyl-4,8-dihydro-1H-imidazo[4,5-d][1,3,6]thiadiazepine-5,7-dithione
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Formula C25H20N4S3
InChI InChI=1S/C25H20N4S3/c1-16-8-12-19(13-9-16)28-22-23(27-21(26-22)18-6-4-3-5-7-18)29(25(31)32-24(28)30)20-14-10-17(2)11-15-20/h3-15H,1-2H3,(H,26,27)
InChIKey QTEJZIUNAZKTNC-UHFFFAOYSA-N
Molecular Weight 472.643 g/mol
SMILES [nH]1c(nc2c1N(C(SC(N2c1ccc(cc1)C)=S)=S)c1ccc(cc1)C)-c1ccccc1
SPLASH splash10-0udi-0901000000-c99821c7838b74bfb460
Source of Spectrum H1-51-779-11
Synonyms 4,8-bis(4-methylphenyl)-2-phenyl-4,8-dihydro-1H-imidazo[4,5-d][1,3,6]thiadiazepine-5,7-dithione
Wiley ID 817199