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3-Cyano-6-phenyl-5-propylamino-1-p-tolyl-1H-pyrazolo[4,3-d]pyrimidin-7(6H)-one
SpectraBase Compound ID 8ZRu9g8DlER
InChI InChI=1S/C22H20N6O/c1-3-13-24-22-25-19-18(14-23)26-28(17-11-9-15(2)10-12-17)20(19)21(29)27(22)16-7-5-4-6-8-16/h4-12H,3,13H2,1-2H3,(H,24,25)
InChIKey PYDYRKFUIZJJAD-UHFFFAOYSA-N
Mol Weight 384.44 g/mol
Molecular Formula C22H20N6O
Exact Mass 384.169859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9iakDaOjIpE
Name 3-Cyano-6-phenyl-5-propylamino-1-p-tolyl-1H-pyrazolo[4,3-d]pyrimidin-7(6H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H20N6O
InChI InChI=1S/C22H20N6O/c1-3-13-24-22-25-19-18(14-23)26-28(17-11-9-15(2)10-12-17)20(19)21(29)27(22)16-7-5-4-6-8-16/h4-12H,3,13H2,1-2H3,(H,24,25)
InChIKey PYDYRKFUIZJJAD-UHFFFAOYSA-N
Molecular Weight 384.443 g/mol
SMILES N(C=1N(C(c2c(N1)c(C#N)n[n]2-c1ccc(cc1)C)=O)c1ccccc1)CCC
SPLASH splash10-000x-4109000000-1cb4f6c645399f58c554
Source of Spectrum F-66-5156-8a
Wiley ID 1683671