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3-Cyano-5-dipropylamino-6-phenyl-1-p-tolyl-1H-pyrazolo[4,3-d]pyrimidin-7(6H)-one
SpectraBase Compound ID 5Pp2GCbBHCJ
InChI InChI=1S/C25H26N6O/c1-4-15-29(16-5-2)25-27-22-21(17-26)28-31(20-13-11-18(3)12-14-20)23(22)24(32)30(25)19-9-7-6-8-10-19/h6-14H,4-5,15-16H2,1-3H3
InChIKey LKSVNIUHQOPYQX-UHFFFAOYSA-N
Mol Weight 426.52 g/mol
Molecular Formula C25H26N6O
Exact Mass 426.216809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 49leutIefI
Name 3-Cyano-5-dipropylamino-6-phenyl-1-p-tolyl-1H-pyrazolo[4,3-d]pyrimidin-7(6H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H26N6O
InChI InChI=1S/C25H26N6O/c1-4-15-29(16-5-2)25-27-22-21(17-26)28-31(20-13-11-18(3)12-14-20)23(22)24(32)30(25)19-9-7-6-8-10-19/h6-14H,4-5,15-16H2,1-3H3
InChIKey LKSVNIUHQOPYQX-UHFFFAOYSA-N
Molecular Weight 426.524 g/mol
SMILES c12c(N=C(N(C2=O)c2ccccc2)N(CCC)CCC)c(C#N)n[n]1-c1ccc(cc1)C
SPLASH splash10-004i-5029200000-5f9e4c7e1c21e57851ff
Source of Spectrum F-66-5118-8C
Wiley ID 1683273