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3-Cyano-5-dipropylamino-6-(4-fluorophenyl)-1-p-tolyl-1H-pyrazolo[4,3-d]pyrimidin-7(6H)-one
SpectraBase Compound ID 68mIFQR8rPP
InChI InChI=1S/C25H25FN6O/c1-4-14-30(15-5-2)25-28-22-21(16-27)29-32(20-10-6-17(3)7-11-20)23(22)24(33)31(25)19-12-8-18(26)9-13-19/h6-13H,4-5,14-15H2,1-3H3
InChIKey BDCSIGVFCYEYCW-UHFFFAOYSA-N
Mol Weight 444.51 g/mol
Molecular Formula C25H25FN6O
Exact Mass 444.207388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9f6mV4qrSkF
Name 3-Cyano-5-dipropylamino-6-(4-fluorophenyl)-1-p-tolyl-1H-pyrazolo[4,3-d]pyrimidin-7(6H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H25FN6O
InChI InChI=1S/C25H25FN6O/c1-4-14-30(15-5-2)25-28-22-21(16-27)29-32(20-10-6-17(3)7-11-20)23(22)24(33)31(25)19-12-8-18(26)9-13-19/h6-13H,4-5,14-15H2,1-3H3
InChIKey BDCSIGVFCYEYCW-UHFFFAOYSA-N
Molecular Weight 444.514 g/mol
SMILES c12c(N=C(N(C2=O)c2ccc(cc2)F)N(CCC)CCC)c(C#N)n[n]1-c1ccc(cc1)C
SPLASH splash10-0f6x-0003900000-2c0bb4e046b0b3794f7e
Source of Spectrum F-66-5119-8H
Wiley ID 1683268