(R)-3-Cyano-6-phenyl-5-(.alpha.-phenylethylamino)-1-p-tolyl-1H-pyrazolo[4,3-d]pyrimidin-7(6H)-one

SpectraBase Compound ID	5WSW6peFh54
InChI	InChI=1S/C27H22N6O/c1-18-13-15-22(16-14-18)33-25-24(23(17-28)31-33)30-27(29-19(2)20-9-5-3-6-10-20)32(26(25)34)21-11-7-4-8-12-21/h3-16,19H,1-2H3,(H,29,30)/t19-/m1/s1
InChIKey	WBZPNRUYBWBLOR-LJQANCHMSA-N Google Search
Mol Weight	446.51 g/mol
Molecular Formula	C27H22N6O
Exact Mass	446.185509 g/mol

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SpectraBase Spectrum ID	sfDDpG6794
Name	(R)-3-Cyano-6-phenyl-5-(.alpha.-phenylethylamino)-1-p-tolyl-1H-pyrazolo[4,3-d]pyrimidin-7(6H)-one
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C27H22N6O
InChI	InChI=1S/C27H22N6O/c1-18-13-15-22(16-14-18)33-25-24(23(17-28)31-33)30-27(29-19(2)20-9-5-3-6-10-20)32(26(25)34)21-11-7-4-8-12-21/h3-16,19H,1-2H3,(H,29,30)/t19-/m1/s1
InChIKey	WBZPNRUYBWBLOR-LJQANCHMSA-N
Molecular Weight	446.514 g/mol
SMILES	N(C=1N(C(c2c(N1)c(C#N)n[n]2-c1ccc(cc1)C)=O)c1ccccc1)[C@@](c1ccccc1)(C)[H]
SPLASH	splash10-0005-1507900000-44195962519017117e89
Source of Spectrum	F-66-5116-8e
Wiley ID	1683293