4-[(2,4-dichlorobenzyl)sulfanyl]-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidine

SpectraBase Compound ID	plghj1ZZFF
InChI	InChI=1S/C19H14Cl2N4S/c1-12-2-6-15(7-3-12)25-18-16(9-24-25)19(23-11-22-18)26-10-13-4-5-14(20)8-17(13)21/h2-9,11H,10H2,1H3
InChIKey	QENOSPOMYYUFCB-UHFFFAOYSA-N Google Search
Mol Weight	401.32 g/mol
Molecular Formula	C19H14Cl2N4S
Exact Mass	400.031623 g/mol

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SpectraBase Spectrum ID	omvk3vsmFU
Name	4-[(2,4-dichlorobenzyl)sulfanyl]-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidine
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/C19H14Cl2N4S/c1-12-2-6-15(7-3-12)25-18-16(9-24-25)19(23-11-22-18)26-10-13-4-5-14(20)8-17(13)21/h2-9,11H,10H2,1H3
InChIKey	QENOSPOMYYUFCB-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_9964
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: D62268; Labnumber: UDSG-05962; SBI_ID: SBI-009967
Synonyms	2,4-dichlorobenzyl 1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl sulfide
Temperature	315 °C