N-(2-methoxy-5-methylphenyl)-2-{[1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}acetamide

SpectraBase Compound ID	J5CHCRsdPOD
InChI	InChI=1S/C22H21N5O2S/c1-14-4-7-16(8-5-14)27-21-17(11-25-27)22(24-13-23-21)30-12-20(28)26-18-10-15(2)6-9-19(18)29-3/h4-11,13H,12H2,1-3H3,(H,26,28)
InChIKey	BQJGTXSUMYQEFN-UHFFFAOYSA-N Google Search
Mol Weight	419.5 g/mol
Molecular Formula	C22H21N5O2S
Exact Mass	419.141596 g/mol

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SpectraBase Spectrum ID	3uhNgMujIsO
Name	N-(2-methoxy-5-methylphenyl)-2-{[1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}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/C22H21N5O2S/c1-14-4-7-16(8-5-14)27-21-17(11-25-27)22(24-13-23-21)30-12-20(28)26-18-10-15(2)6-9-19(18)29-3/h4-11,13H,12H2,1-3H3,(H,26,28)
InChIKey	BQJGTXSUMYQEFN-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_9908
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: D62178; Labnumber: UDSG-05842; SBI_ID: SBI-009911
Temperature	315 °C