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3,6-Dihydro-3-(4-chlorophenyl)-6-phenyl-5-(N-methyl-N-phenylamino)-7H-1,2,3-triazolo[4,5-d]pyrimidin-7-one
SpectraBase Compound ID CUOzKQpW8ky
InChI InChI=1S/C23H17ClN6O/c1-28(17-8-4-2-5-9-17)23-25-21-20(22(31)29(23)18-10-6-3-7-11-18)26-27-30(21)19-14-12-16(24)13-15-19/h2-15H,1H3
InChIKey SQDZTWBPWKJGGE-UHFFFAOYSA-N
Mol Weight 428.88 g/mol
Molecular Formula C23H17ClN6O
Exact Mass 428.115237 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IVNeZ32rYPS
Name 3,6-Dihydro-3-(4-chlorophenyl)-6-phenyl-5-(N-methyl-N-phenylamino)-7H-1,2,3-triazolo[4,5-d]pyrimidin-7-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H17ClN6O
InChI InChI=1S/C23H17ClN6O/c1-28(17-8-4-2-5-9-17)23-25-21-20(22(31)29(23)18-10-6-3-7-11-18)26-27-30(21)19-14-12-16(24)13-15-19/h2-15H,1H3
InChIKey SQDZTWBPWKJGGE-UHFFFAOYSA-N
Molecular Weight 428.883 g/mol
SMILES C1(=Nc2c(C(N1c1ccccc1)=O)nn[n]2-c1ccc(cc1)Cl)N(c1ccccc1)C
SPLASH splash10-004i-9030600000-4a39421bf2c4ad5ada5d
Source of Spectrum F4-0-2546-4
Synonyms 3-(4-Chlorophenyl)-5-(methylanilino)-6-phenyl-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Wiley ID 1618722