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

SpectraBase Compound ID	HxsG9K544Lu
InChI	InChI=1S/C22H21N5O3S/c1-29-17-8-16(9-18(10-17)30-2)26-20(28)13-31-22-19-11-25-27(21(19)23-14-24-22)12-15-6-4-3-5-7-15/h3-11,14H,12-13H2,1-2H3,(H,26,28)
InChIKey	XJMMEPRMKHXSIP-UHFFFAOYSA-N Google Search
Mol Weight	435.5 g/mol
Molecular Formula	C22H21N5O3S
Exact Mass	435.136511 g/mol

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SpectraBase Spectrum ID	DvEtU4qk5I2
Name	2-[(1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]-N-(3,5-dimethoxyphenyl)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/C22H21N5O3S/c1-29-17-8-16(9-18(10-17)30-2)26-20(28)13-31-22-19-11-25-27(21(19)23-14-24-22)12-15-6-4-3-5-7-15/h3-11,14H,12-13H2,1-2H3,(H,26,28)
InChIKey	XJMMEPRMKHXSIP-UHFFFAOYSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_25817
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: D62456; Labnumber: UDSG-06660; SBI_ID: SBI-025821
Temperature	318 °C