1-(4-bromophenyl)-4-[(1-naphthylmethyl)sulfanyl]-1H-pyrazolo[3,4-d]pyrimidine

SpectraBase Compound ID	JfI5d9UJ8rV
InChI	InChI=1S/C22H15BrN4S/c23-17-8-10-18(11-9-17)27-21-20(12-26-27)22(25-14-24-21)28-13-16-6-3-5-15-4-1-2-7-19(15)16/h1-12,14H,13H2
InChIKey	DVYCQBQWEZQQNO-UHFFFAOYSA-N Google Search
Mol Weight	447.35 g/mol
Molecular Formula	C22H15BrN4S
Exact Mass	446.020081 g/mol

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SpectraBase Spectrum ID	85HibME9WHQ
Name	1-(4-bromophenyl)-4-[(1-naphthylmethyl)sulfanyl]-1H-pyrazolo[3,4-d]pyrimidine
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C22H15BrN4S/c23-17-8-10-18(11-9-17)27-21-20(12-26-27)22(25-14-24-21)28-13-16-6-3-5-15-4-1-2-7-19(15)16/h1-12,14H,13H2
InChIKey	DVYCQBQWEZQQNO-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_10014
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: D62417; Labnumber: UDSG-06444; SBI_ID: SBI-010017
Synonyms	1-(4-bromophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl 1-naphthylmethyl sulfide
Temperature	318 °C