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6-[(p-Chlorophenyl)amino]-3,5-dihydro-3,5-diphenyl-1,2,3-triazolo[4,5-d]-1,2,4-triazolo[1,5-a]pyrimidin-9-one
SpectraBase Compound ID 2Q1ymksRbgn
InChI InChI=1S/C23H15ClN8O/c24-15-11-13-16(14-12-15)25-22-28-32-21(33)19-20(31(29-27-19)18-9-5-2-6-10-18)26-23(32)30(22)17-7-3-1-4-8-17/h1-14H,(H,25,28)
InChIKey KASCOLSSELYDAD-UHFFFAOYSA-N
Mol Weight 454.88 g/mol
Molecular Formula C23H15ClN8O
Exact Mass 454.105735 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6k2yHcStBhA
Name 6-[(p-Chlorophenyl)amino]-3,5-dihydro-3,5-diphenyl-1,2,3-triazolo[4,5-d]-1,2,4-triazolo[1,5-a]pyrimidin-9-one
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Formula C23H15ClN8O
InChI InChI=1S/C23H15ClN8O/c24-15-11-13-16(14-12-15)25-22-28-32-21(33)19-20(31(29-27-19)18-9-5-2-6-10-18)26-23(32)30(22)17-7-3-1-4-8-17/h1-14H,(H,25,28)
InChIKey KASCOLSSELYDAD-UHFFFAOYSA-N
Molecular Weight 454.881 g/mol
SMILES N(C1=NN2C(=Nc3c(C2=O)nn[n]3-c2ccccc2)N1c1ccccc1)c1ccc(cc1)Cl
SPLASH splash10-004i-9020200000-52eaedad021bf971a100
Source of Spectrum F5-4-133-10b
Synonyms 6-((4-chlorophenyl)amino)-3,5-diphenyl-3H-[1,2,3]triazolo[4,5-d][1,2,4]triazolo[1,5-a]pyrimidin-9(5H)-one
Wiley ID 1732637