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1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-1-(4-bromophenyl)ethylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide

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1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-1-(4-bromophenyl)ethylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
SpectraBase Compound ID EUqY6Q6rIdF
InChI InChI=1S/C20H17BrN8O2S/c1-12(13-7-9-14(21)10-8-13)23-25-20(30)17-16(11-32-15-5-3-2-4-6-15)29(28-24-17)19-18(22)26-31-27-19/h2-10H,11H2,1H3,(H2,22,26)(H,25,30)/b23-12+
InChIKey YKPVVCBOZNTHOA-FSJBWODESA-N
Mol Weight 513.37 g/mol
Molecular Formula C20H17BrN8O2S
Exact Mass 512.037856 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IB7g9RhKIBv
Name 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-1-(4-bromophenyl)ethylidene]-5-[(phenylsulfanyl)methyl]-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/C20H17BrN8O2S/c1-12(13-7-9-14(21)10-8-13)23-25-20(30)17-16(11-32-15-5-3-2-4-6-15)29(28-24-17)19-18(22)26-31-27-19/h2-10H,11H2,1H3,(H2,22,26)(H,25,30)/b23-12+
InChIKey YKPVVCBOZNTHOA-FSJBWODESA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_23168
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: D37158; Labnumber: NIG1-2195; SBI_ID: SBI-023172
Synonyms 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[1-(4-bromophenyl)ethylidene]-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Temperature 313 °C