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6-[(p-Methylphenyl)amino]-5-(4'-methylphenyl)-3,5-dihydro-3-phenyl-1,2,3-triazolo[4,5-d]-1,2,4-triazolo[1,5-a]pyrimidin-9-one

View entire compound with spectra: 1 MS (GC)

6-[(p-Methylphenyl)amino]-5-(4'-methylphenyl)-3,5-dihydro-3-phenyl-1,2,3-triazolo[4,5-d]-1,2,4-triazolo[1,5-a]pyrimidin-9-one
SpectraBase Compound ID KXWy4ZWSsBm
InChI InChI=1S/C25H20N8O/c1-16-8-12-18(13-9-16)26-24-29-33-23(34)21-22(32(30-28-21)20-6-4-3-5-7-20)27-25(33)31(24)19-14-10-17(2)11-15-19/h3-15H,1-2H3,(H,26,29)
InChIKey JMYBGILNVAGCQA-UHFFFAOYSA-N
Mol Weight 448.49 g/mol
Molecular Formula C25H20N8O
Exact Mass 448.176007 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3UMUdA1LgY8
Name 6-[(p-Methylphenyl)amino]-5-(4'-methylphenyl)-3,5-dihydro-3-phenyl-1,2,3-triazolo[4,5-d]-1,2,4-triazolo[1,5-a]pyrimidin-9-one
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Formula C25H20N8O
InChI InChI=1S/C25H20N8O/c1-16-8-12-18(13-9-16)26-24-29-33-23(34)21-22(32(30-28-21)20-6-4-3-5-7-20)27-25(33)31(24)19-14-10-17(2)11-15-19/h3-15H,1-2H3,(H,26,29)
InChIKey JMYBGILNVAGCQA-UHFFFAOYSA-N
Molecular Weight 448.490 g/mol
SMILES N(C1=NN2C(=Nc3c(C2=O)nn[n]3-c2ccccc2)N1c1ccc(cc1)C)c1ccc(cc1)C
SPLASH splash10-0007-9050700000-3df94879c8c407cb3fa8
Source of Spectrum F5-4-133-10h
Synonyms 3-Phenyl-5-(p-tolyl)-6-(p-tolylamino)-3H-[1,2,3]triazolo[4,5-d][1,2,4]triazolo[1,5-a]pyrimidin-9(5H)-one
Wiley ID 1732631