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6-[(4-chlorophenyl)imino]-1-(p-methoxyphenyl)-5-phenyl-5,6-dihydro-1H-[1,2,3]triazolo[4,5-d]pyrimidine
SpectraBase Compound ID EfJ6iGxsYa4
InChI InChI=1S/C24H19ClN6O/c1-32-21-13-11-20(12-14-21)31-22-15-30(16-26-19-9-7-18(25)8-10-19)24(27-23(22)28-29-31)17-5-3-2-4-6-17/h2-16,24H,1H3/b26-16+
InChIKey DSHXFAOPFKYYEU-WGOQTCKBSA-N
Mol Weight 442.91 g/mol
Molecular Formula C24H19ClN6O
Exact Mass 442.130887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DaO9RtPNZXs
Name 6-[(4-chlorophenyl)imino]-1-(p-methoxyphenyl)-5-phenyl-5,6-dihydro-1H-[1,2,3]triazolo[4,5-d]pyrimidine
CAS Registry Number 115462-12-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H19ClN6O
InChI InChI=1S/C24H19ClN6O/c1-32-21-13-11-20(12-14-21)31-22-15-30(16-26-19-9-7-18(25)8-10-19)24(27-23(22)28-29-31)17-5-3-2-4-6-17/h2-16,24H,1H3/b26-16+
InChIKey DSHXFAOPFKYYEU-WGOQTCKBSA-N
Molecular Weight 442.910 g/mol
SMILES C1=2C(=NC(N(C2)\C=N\c2ccc(cc2)Cl)c2ccccc2)N=NN1c1ccc(cc1)OC
SPLASH splash10-00di-1900000000-0ea8e3cb5b75a18f817b
Source of Spectrum J-53-4661-25
Synonyms 4-Chloro-N-{(E)-[1-(4-methoxyphenyl)-5-phenyl-1,5-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]methylidene}aniline N-(4-chlorophenyl)-N-{(E)-[1-(4-methoxyphenyl)-5-phenyl-1,5-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]methylidene}amine
Wiley ID 1385291