acetic acid, [[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-1-(3-bromophenyl)ethylidene]hydrazide

SpectraBase Compound ID	89NkZdxEGpf
InChI	InChI=1S/C21H22BrN5O2S/c1-4-27-20(15-8-10-18(29-3)11-9-15)25-26-21(27)30-13-19(28)24-23-14(2)16-6-5-7-17(22)12-16/h5-12H,4,13H2,1-3H3,(H,24,28)/b23-14+
InChIKey	SDEVJGCOQLNZSA-OEAKJJBVSA-N Google Search
Mol Weight	488.4 g/mol
Molecular Formula	C21H22BrN5O2S
Exact Mass	487.067759 g/mol

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SpectraBase Spectrum ID	LjEEwcKkqSB
Name	acetic acid, [[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-1-(3-bromophenyl)ethylidene]hydrazide
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/C21H22BrN5O2S/c1-4-27-20(15-8-10-18(29-3)11-9-15)25-26-21(27)30-13-19(28)24-23-14(2)16-6-5-7-17(22)12-16/h5-12H,4,13H2,1-3H3,(H,24,28)/b23-14+
InChIKey	SDEVJGCOQLNZSA-OEAKJJBVSA-N
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Origin	1H_CB_8313_5731
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/10259024