2-{[(1-(4-amino-1,2,5-oxadiazol-3-yl)-4-{[(2E)-2-(4-methoxybenzylidene)hydrazino]carbonyl}-1H-1,2,3-triazol-5-yl)methyl]amino}benzamide

SpectraBase Compound ID	1nvlz7QKpyY
InChI	InChI=1S/C21H20N10O4/c1-34-13-8-6-12(7-9-13)10-25-27-21(33)17-16(31(30-26-17)20-18(22)28-35-29-20)11-24-15-5-3-2-4-14(15)19(23)32/h2-10,24H,11H2,1H3,(H2,22,28)(H2,23,32)(H,27,33)/b25-10+
InChIKey	GTGJYKMILWPYOY-KIBLKLHPSA-N Google Search
Mol Weight	476.46 g/mol
Molecular Formula	C21H20N10O4
Exact Mass	476.166899 g/mol

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SpectraBase Spectrum ID	9Ubt4s8kEmW
Name	2-{[(1-(4-amino-1,2,5-oxadiazol-3-yl)-4-{[(2E)-2-(4-methoxybenzylidene)hydrazino]carbonyl}-1H-1,2,3-triazol-5-yl)methyl]amino}benzamide
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/C21H20N10O4/c1-34-13-8-6-12(7-9-13)10-25-27-21(33)17-16(31(30-26-17)20-18(22)28-35-29-20)11-24-15-5-3-2-4-14(15)19(23)32/h2-10,24H,11H2,1H3,(H2,22,28)(H2,23,32)(H,27,33)/b25-10+
InChIKey	GTGJYKMILWPYOY-KIBLKLHPSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_13091
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: D79944; Labnumber: NIG2-0207; SBI_ID: SBI-013094
Synonyms	2-{[(1-(4-amino-1,2,5-oxadiazol-3-yl)-4-{[2-(4-methoxybenzylidene)hydrazino]carbonyl}-1H-1,2,3-triazol-5-yl)methyl]amino}benzamide
Temperature	315 °C