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2-[(1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]-N-(2,5-dimethylphenyl)acetamide

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2-[(1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]-N-(2,5-dimethylphenyl)acetamide
SpectraBase Compound ID IEq80AARhL7
InChI InChI=1S/C22H21N5OS/c1-15-8-9-16(2)19(10-15)26-20(28)13-29-22-18-11-25-27(21(18)23-14-24-22)12-17-6-4-3-5-7-17/h3-11,14H,12-13H2,1-2H3,(H,26,28)
InChIKey KUMHBWNDTZJRCL-UHFFFAOYSA-N
Mol Weight 403.5 g/mol
Molecular Formula C22H21N5OS
Exact Mass 403.146681 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AwP7DyvwjDo
Name 2-[(1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]-N-(2,5-dimethylphenyl)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/C22H21N5OS/c1-15-8-9-16(2)19(10-15)26-20(28)13-29-22-18-11-25-27(21(18)23-14-24-22)12-17-6-4-3-5-7-17/h3-11,14H,12-13H2,1-2H3,(H,26,28)
InChIKey KUMHBWNDTZJRCL-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_26238
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: D62549; Labnumber: UDSG-06790; SBI_ID: SBI-026242
Temperature 308 °C