isopropyl 4-({[2-(4-amino-1,2,5-oxadiazol-3-yl)-1H-benzimidazol-1-yl]acetyl}amino)benzoate

SpectraBase Compound ID	Ep46AcW7Za7
InChI	InChI=1S/C21H20N6O4/c1-12(2)30-21(29)13-7-9-14(10-8-13)23-17(28)11-27-16-6-4-3-5-15(16)24-20(27)18-19(22)26-31-25-18/h3-10,12H,11H2,1-2H3,(H2,22,26)(H,23,28)
InChIKey	JXZMLHQKRFKJSS-UHFFFAOYSA-N Google Search
Mol Weight	420.43 g/mol
Molecular Formula	C21H20N6O4
Exact Mass	420.154603 g/mol

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SpectraBase Spectrum ID	9430HbBxI09
Name	isopropyl 4-({[2-(4-amino-1,2,5-oxadiazol-3-yl)-1H-benzimidazol-1-yl]acetyl}amino)benzoate
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/C21H20N6O4/c1-12(2)30-21(29)13-7-9-14(10-8-13)23-17(28)11-27-16-6-4-3-5-15(16)24-20(27)18-19(22)26-31-25-18/h3-10,12H,11H2,1-2H3,(H2,22,26)(H,23,28)
InChIKey	JXZMLHQKRFKJSS-UHFFFAOYSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_ASIOH_7000_6162
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: NMR/11242404; Labnumber: SAD-0003062; IOH_ID: IOH-006163