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N-(3-methoxyphenyl)-2-{[1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}acetamide
SpectraBase Compound ID IFvCCvMSjEr
InChI InChI=1S/C21H19N5O2S/c1-14-6-8-16(9-7-14)26-20-18(11-24-26)21(23-13-22-20)29-12-19(27)25-15-4-3-5-17(10-15)28-2/h3-11,13H,12H2,1-2H3,(H,25,27)
InChIKey QDIORGPGVRKLIO-UHFFFAOYSA-N
Mol Weight 405.48 g/mol
Molecular Formula C21H19N5O2S
Exact Mass 405.125946 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9QrN7YkiBUY
Name N-(3-methoxyphenyl)-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/C21H19N5O2S/c1-14-6-8-16(9-7-14)26-20-18(11-24-26)21(23-13-22-20)29-12-19(27)25-15-4-3-5-17(10-15)28-2/h3-11,13H,12H2,1-2H3,(H,25,27)
InChIKey QDIORGPGVRKLIO-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_9919
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: D62192; Labnumber: UDSG-05858; SBI_ID: SBI-009922
Temperature 315 °C