1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((E)-{2-[(4-fluorobenzyl)oxy]phenyl}methylidene)-5-isopropyl-1H-1,2,3-triazole-4-carbohydrazide

SpectraBase Compound ID	3IATnM6qpvc
InChI	InChI=1S/C22H21FN8O3/c1-13(2)19-18(26-30-31(19)21-20(24)28-34-29-21)22(32)27-25-11-15-5-3-4-6-17(15)33-12-14-7-9-16(23)10-8-14/h3-11,13H,12H2,1-2H3,(H2,24,28)(H,27,32)/b25-11+
InChIKey	SSXJSUXUOVFIOB-OPEKNORGSA-N Google Search
Mol Weight	464.46 g/mol
Molecular Formula	C22H21FN8O3
Exact Mass	464.172065 g/mol

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SpectraBase Spectrum ID	7bCfqACfhv
Name	1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-((E)-{2-[(4-fluorobenzyl)oxy]phenyl}methylidene)-5-isopropyl-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/C22H21FN8O3/c1-13(2)19-18(26-30-31(19)21-20(24)28-34-29-21)22(32)27-25-11-15-5-3-4-6-17(15)33-12-14-7-9-16(23)10-8-14/h3-11,13H,12H2,1-2H3,(H2,24,28)(H,27,32)/b25-11+
InChIKey	SSXJSUXUOVFIOB-OPEKNORGSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_8792
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: D37373; Labnumber: NIG1-2820; SBI_ID: SBI-008795
Synonyms	1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-({2-[(4-fluorobenzyl)oxy]phenyl}methylidene)-5-isopropyl-1H-1,2,3-triazole-4-carbohydrazide
Temperature	315 °C