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7-Cyano-3,5-diphenyl-2-(piperidin-1-yl)-3H-pyrrolo[3,2-d]pyrimidine-4(5H)-one
SpectraBase Compound ID 7GPTJ0rf5uB
InChI InChI=1S/C24H21N5O/c25-16-18-17-28(19-10-4-1-5-11-19)22-21(18)26-24(27-14-8-3-9-15-27)29(23(22)30)20-12-6-2-7-13-20/h1-2,4-7,10-13,17H,3,8-9,14-15H2
InChIKey QQUJIAJJCBCLRD-UHFFFAOYSA-N
Mol Weight 395.47 g/mol
Molecular Formula C24H21N5O
Exact Mass 395.17461 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I8SBBX3j2yq
Name 7-Cyano-3,5-diphenyl-2-(piperidin-1-yl)-3H-pyrrolo[3,2-d]pyrimidine-4(5H)-one
Alternate Name(s) 4-Oxo-3,5-diphenyl-2-(piperidin-1-yl)-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidine-7-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H21N5O
InChI InChI=1S/C24H21N5O/c25-16-18-17-28(19-10-4-1-5-11-19)22-21(18)26-24(27-14-8-3-9-15-27)29(23(22)30)20-12-6-2-7-13-20/h1-2,4-7,10-13,17H,3,8-9,14-15H2
InChIKey QQUJIAJJCBCLRD-UHFFFAOYSA-N
Molecular Weight 395.466 g/mol
SMILES c12c(N=C(N(C2=O)c2ccccc2)N2CCCCC2)c(C#N)c[n]1-c1ccccc1
SPLASH splash10-03gj-5549000000-4e4f5c6f378f9d95f5bf
Source of Spectrum Y-51-E94-6c
Wiley ID 1742242