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3-(4-Chlorophenyl)-5-(4-methylphenoxy)-6-(3-methylphenyl)-7-triazolo[4,5-d]pyrimidinone

View entire compound with spectra: 1 MS (GC)

3-(4-Chlorophenyl)-5-(4-methylphenoxy)-6-(3-methylphenyl)-7-triazolo[4,5-d]pyrimidinone
SpectraBase Compound ID KZo74ZYuWbn
InChI InChI=1S/C24H18ClN5O2/c1-15-6-12-20(13-7-15)32-24-26-22-21(23(31)29(24)19-5-3-4-16(2)14-19)27-28-30(22)18-10-8-17(25)9-11-18/h3-14H,1-2H3
InChIKey BDKLHCVNNJJYRZ-UHFFFAOYSA-N
Mol Weight 443.89 g/mol
Molecular Formula C24H18ClN5O2
Exact Mass 443.114903 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kh9K0OFwAto
Name 3-(4-Chlorophenyl)-5-(4-methylphenoxy)-6-(3-methylphenyl)-7-triazolo[4,5-d]pyrimidinone
Alternate Name(s) 3-(4-Chlorophenyl)-5-(4-methylphenoxy)-6-(3-methylphenyl)-[1,2,3]triazolo[4,5-d]pyrimidin-7-one 3-(4-Chlorophenyl)-5-(4-methylphenoxy)-6-(3-methylphenyl)triazolo[4,5-d]pyrimidin-7-one 3-(4-Chlorophenyl)-5-(4-methylphenoxy)-6-(m-tolyl)triazolo[4,5-d]pyrimidin-7-one
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Formula C24H18ClN5O2
InChI InChI=1S/C24H18ClN5O2/c1-15-6-12-20(13-7-15)32-24-26-22-21(23(31)29(24)19-5-3-4-16(2)14-19)27-28-30(22)18-10-8-17(25)9-11-18/h3-14H,1-2H3
InChIKey BDKLHCVNNJJYRZ-UHFFFAOYSA-N
Molecular Weight 443.894 g/mol
SMILES C1(=Nc2c(C(N1c1cc(ccc1)C)=O)nn[n]2-c1ccc(cc1)Cl)Oc1ccc(cc1)C
SPLASH splash10-000i-9100100000-3cc93e9217e56f16d050
Source of Spectrum F4-0-2547-4
Wiley ID 1618712