3-(benzylthio)-6-[(2-methylbenzyl)amino]-1,5-diphenyl-pyrazolo[3,4-d]pyrimidin-4-one

SpectraBase Compound ID	FniVaX5MLp3
InChI	InChI=1S/C32H27N5OS/c1-23-13-11-12-16-25(23)21-33-32-34-29-28(31(38)36(32)26-17-7-3-8-18-26)30(39-22-24-14-5-2-6-15-24)35-37(29)27-19-9-4-10-20-27/h2-20H,21-22H2,1H3,(H,33,34)
InChIKey	SZAIRTOFZRCOQA-UHFFFAOYSA-N Google Search
Mol Weight	529.7 g/mol
Molecular Formula	C32H27N5OS
Exact Mass	529.193632 g/mol

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SpectraBase Spectrum ID	AO96IZo8DNE
Name	3-(benzylthio)-6-[(2-methylbenzyl)amino]-1,5-diphenyl-pyrazolo[3,4-d]pyrimidin-4-one
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C32H27N5OS
InChI	InChI=1S/C32H27N5OS/c1-23-13-11-12-16-25(23)21-33-32-34-29-28(31(38)36(32)26-17-7-3-8-18-26)30(39-22-24-14-5-2-6-15-24)35-37(29)27-19-9-4-10-20-27/h2-20H,21-22H2,1H3,(H,33,34)
InChIKey	SZAIRTOFZRCOQA-UHFFFAOYSA-N
Molecular Weight	529.662 g/mol
SMILES	N(C1=Nc2c(C(=O)N1c1ccccc1)c(SCc1ccccc1)n[n]2-c1ccccc1)Cc1c(C)cccc1
SPLASH	splash10-0a4l-6900310000-ef9362d440cedfd8b340
Source of Spectrum	AJ-41-396-5
Synonyms	3-Benzylsulfanyl-6-(o-tolylmethylamino)-1,5-diphenyl-pyrazolo[3,4-d]pyrimidin-4-one 3-Benzylsulfanyl-6-[(2-methylphenyl)methylamino]-1,5-diphenylpyrazolo[3,4-d]pyrimidin-4-one 6-[(2-methylphenyl)methylamino]-1,5-diphenyl-3-(phenylmethylsulfanyl)pyrazolo[3,4-d]pyrimidin-4-one 6-[(2-methylphenyl)methylamino]-1,5-diphenyl-3-(phenylmethylthio)-4-pyrazolo[3,4-d]pyrimidinone
Wiley ID	1567509