2-{[1-(4-bromophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}-N-(4-butylphenyl)acetamide

SpectraBase Compound ID	1vx6wIGKJma
InChI	InChI=1S/C23H22BrN5OS/c1-2-3-4-16-5-9-18(10-6-16)28-21(30)14-31-23-20-13-27-29(22(20)25-15-26-23)19-11-7-17(24)8-12-19/h5-13,15H,2-4,14H2,1H3,(H,28,30)
InChIKey	NHTIVMAADASMKD-UHFFFAOYSA-N Google Search
Mol Weight	496.43 g/mol
Molecular Formula	C23H22BrN5OS
Exact Mass	495.072845 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	FJXXxx2jxAK
Name	2-{[1-(4-bromophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}-N-(4-butylphenyl)acetamide
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/C23H22BrN5OS/c1-2-3-4-16-5-9-18(10-6-16)28-21(30)14-31-23-20-13-27-29(22(20)25-15-26-23)19-11-7-17(24)8-12-19/h5-13,15H,2-4,14H2,1H3,(H,28,30)
InChIKey	NHTIVMAADASMKD-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_10023
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: D62438; Labnumber: UDSG-06470; SBI_ID: SBI-010026
Temperature	318 °C