1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[cyclohexyl(methyl)amino]methyl}-N'-[(E)-(2,4-dihydroxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide

SpectraBase Compound ID	5TfYo3k70vU
InChI	InChI=1S/C20H25N9O4/c1-28(13-5-3-2-4-6-13)11-15-17(23-27-29(15)19-18(21)25-33-26-19)20(32)24-22-10-12-7-8-14(30)9-16(12)31/h7-10,13,30-31H,2-6,11H2,1H3,(H2,21,25)(H,24,32)/b22-10+
InChIKey	JFLJLTAKGOBOLC-LSHDLFTRSA-N Google Search
Mol Weight	455.48 g/mol
Molecular Formula	C20H25N9O4
Exact Mass	455.20295 g/mol

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SpectraBase Spectrum ID	71JolNKQ43Y
Name	1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[cyclohexyl(methyl)amino]methyl}-N'-[(E)-(2,4-dihydroxyphenyl)methylidene]-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/C20H25N9O4/c1-28(13-5-3-2-4-6-13)11-15-17(23-27-29(15)19-18(21)25-33-26-19)20(32)24-22-10-12-7-8-14(30)9-16(12)31/h7-10,13,30-31H,2-6,11H2,1H3,(H2,21,25)(H,24,32)/b22-10+
InChIKey	JFLJLTAKGOBOLC-LSHDLFTRSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_28096
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: D80355; Labnumber: NIG2-2434; SBI_ID: SBI-028100
Synonyms	1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[cyclohexyl(methyl)amino]methyl}-N'-[(2,4-dihydroxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Temperature	318 °C