1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3,4-dimethoxyphenyl)methylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide

SpectraBase Compound ID	LuCvaWjmJyu
InChI	InChI=1S/C21H20N8O4S/c1-31-16-9-8-13(10-17(16)32-2)11-23-25-21(30)18-15(12-34-14-6-4-3-5-7-14)29(28-24-18)20-19(22)26-33-27-20/h3-11H,12H2,1-2H3,(H2,22,26)(H,25,30)/b23-11+
InChIKey	PDOSXRZFOMKZST-FOKLQQMPSA-N Google Search
Mol Weight	480.5 g/mol
Molecular Formula	C21H20N8O4S
Exact Mass	480.132822 g/mol

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SpectraBase Spectrum ID	AHmQ5uE4Dt9
Name	1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3,4-dimethoxyphenyl)methylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
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/C21H20N8O4S/c1-31-16-9-8-13(10-17(16)32-2)11-23-25-21(30)18-15(12-34-14-6-4-3-5-7-14)29(28-24-18)20-19(22)26-33-27-20/h3-11H,12H2,1-2H3,(H2,22,26)(H,25,30)/b23-11+
InChIKey	PDOSXRZFOMKZST-FOKLQQMPSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_25168
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: D49298; Labnumber: NIG1-3339; SBI_ID: SBI-025172
Synonyms	1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(3,4-dimethoxyphenyl)methylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Temperature	300 °C