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

SpectraBase Compound ID	FNZQC2Pb7LD
InChI	InChI=1S/C21H18N8O4S/c1-12(13-7-8-16-17(9-13)32-11-31-16)23-25-21(30)18-15(10-34-14-5-3-2-4-6-14)29(28-24-18)20-19(22)26-33-27-20/h2-9H,10-11H2,1H3,(H2,22,26)(H,25,30)/b23-12+
InChIKey	VCAIZMPGGGTSGW-FSJBWODESA-N Google Search
Mol Weight	478.49 g/mol
Molecular Formula	C21H18N8O4S
Exact Mass	478.117172 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	7dpbiQ6SXmq
Name	1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-1-(1,3-benzodioxol-5-yl)ethylidene]-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/C21H18N8O4S/c1-12(13-7-8-16-17(9-13)32-11-31-16)23-25-21(30)18-15(10-34-14-5-3-2-4-6-14)29(28-24-18)20-19(22)26-33-27-20/h2-9H,10-11H2,1H3,(H2,22,26)(H,25,30)/b23-12+
InChIKey	VCAIZMPGGGTSGW-FSJBWODESA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_23395
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: D37542; Labnumber: NIG1-3400; SBI_ID: SBI-023399
Synonyms	1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[1-(1,3-benzodioxol-5-yl)ethylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Temperature	315 °C