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

SpectraBase Compound ID	EqjnPLyMTwC
InChI	InChI=1S/C22H20ClN5OS/c1-14(2)17-5-3-4-6-19(17)27-20(29)12-30-22-18-11-26-28(21(18)24-13-25-22)16-9-7-15(23)8-10-16/h3-11,13-14H,12H2,1-2H3,(H,27,29)
InChIKey	DOJXOEZRJNKVSZ-UHFFFAOYSA-N Google Search
Mol Weight	437.95 g/mol
Molecular Formula	C22H20ClN5OS
Exact Mass	437.107709 g/mol

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SpectraBase Spectrum ID	EI8S7oKR4PX
Name	2-{[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}-N-(2-isopropylphenyl)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/C22H20ClN5OS/c1-14(2)17-5-3-4-6-19(17)27-20(29)12-30-22-18-11-26-28(21(18)24-13-25-22)16-9-7-15(23)8-10-16/h3-11,13-14H,12H2,1-2H3,(H,27,29)
InChIKey	DOJXOEZRJNKVSZ-UHFFFAOYSA-N
NMR Offset	15.449
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_10007
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: D62376; Labnumber: UDSG-06274; SBI_ID: SBI-010010
Temperature	308 °C