[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 6-[2-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)ethyl]-3-(4-pyridinyl)-

SpectraBase Compound ID	1TXiVLDX3B5
InChI	InChI=1S/C21H19N7S/c1-14-18(15(2)27(25-14)17-6-4-3-5-7-17)8-9-19-26-28-20(23-24-21(28)29-19)16-10-12-22-13-11-16/h3-7,10-13H,8-9H2,1-2H3
InChIKey	KIVGQRANMKYBNC-UHFFFAOYSA-N Google Search
Mol Weight	401.49 g/mol
Molecular Formula	C21H19N7S
Exact Mass	401.142265 g/mol

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SpectraBase Spectrum ID	FOznR9wGq4r
Name	[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 6-[2-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)ethyl]-3-(4-pyridinyl)-
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/C21H19N7S/c1-14-18(15(2)27(25-14)17-6-4-3-5-7-17)8-9-19-26-28-20(23-24-21(28)29-19)16-10-12-22-13-11-16/h3-7,10-13H,8-9H2,1-2H3
InChIKey	KIVGQRANMKYBNC-UHFFFAOYSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_11628_3400
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: F17641; Labnumber: BAL4-9329