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

SpectraBase Compound ID	4XGbZz5xN42
InChI	InChI=1S/C22H29N9O4/c1-30(15-9-5-4-6-10-15)13-16-18(25-29-31(16)21-20(23)27-35-28-21)22(32)26-24-12-14-8-7-11-17(33-2)19(14)34-3/h7-8,11-12,15H,4-6,9-10,13H2,1-3H3,(H2,23,27)(H,26,32)/b24-12+
InChIKey	UABSJQRCLXKOQJ-WYMPLXKRSA-N Google Search
Mol Weight	483.53 g/mol
Molecular Formula	C22H29N9O4
Exact Mass	483.23425 g/mol

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SpectraBase Spectrum ID	5liOqiiMEKo
Name	1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[cyclohexyl(methyl)amino]methyl}-N'-[(E)-(2,3-dimethoxyphenyl)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/C22H29N9O4/c1-30(15-9-5-4-6-10-15)13-16-18(25-29-31(16)21-20(23)27-35-28-21)22(32)26-24-12-14-8-7-11-17(33-2)19(14)34-3/h7-8,11-12,15H,4-6,9-10,13H2,1-3H3,(H2,23,27)(H,26,32)/b24-12+
InChIKey	UABSJQRCLXKOQJ-WYMPLXKRSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_3676
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: D80064; Labnumber: NIG2-0930; SBI_ID: SBI-003678
Synonyms	1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[cyclohexyl(methyl)amino]methyl}-N'-[(2,3-dimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Temperature	318 °C