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3,6-Dihydro-3-(4-chlorophenyl)-6-phenyl-5-diethylamino-7H-1,2,3-triazolo[4,5-d]pyrimidin-7-one
SpectraBase Compound ID 8CczgiPBjaN
InChI InChI=1S/C20H19ClN6O/c1-3-25(4-2)20-22-18-17(19(28)26(20)15-8-6-5-7-9-15)23-24-27(18)16-12-10-14(21)11-13-16/h5-13H,3-4H2,1-2H3
InChIKey AFKLMEVJEWKLAJ-UHFFFAOYSA-N
Mol Weight 394.87 g/mol
Molecular Formula C20H19ClN6O
Exact Mass 394.130887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 81JKPf5K3iT
Name 3,6-Dihydro-3-(4-chlorophenyl)-6-phenyl-5-diethylamino-7H-1,2,3-triazolo[4,5-d]pyrimidin-7-one
Alternate Name(s) 3-(4-Chlorophenyl)-5-(diethylamino)-6-phenyl-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19ClN6O
InChI InChI=1S/C20H19ClN6O/c1-3-25(4-2)20-22-18-17(19(28)26(20)15-8-6-5-7-9-15)23-24-27(18)16-12-10-14(21)11-13-16/h5-13H,3-4H2,1-2H3
InChIKey AFKLMEVJEWKLAJ-UHFFFAOYSA-N
Molecular Weight 394.866 g/mol
SMILES C1(=Nc2c(C(N1c1ccccc1)=O)nn[n]2-c1ccc(cc1)Cl)N(CC)CC
SPLASH splash10-004r-9700000000-e54c72ddfc959a3a2f1b
Source of Spectrum F4-0-2546-4
Wiley ID 1618723