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

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1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-N'-[(E)-(2-fluorophenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
SpectraBase Compound ID 8KAmZEsJdFz
InChI InChI=1S/C19H14ClFN8O2S/c20-12-5-7-13(8-6-12)32-10-15-16(24-28-29(15)18-17(22)26-31-27-18)19(30)25-23-9-11-3-1-2-4-14(11)21/h1-9H,10H2,(H2,22,26)(H,25,30)/b23-9+
InChIKey XFYSWFUZJXLNKQ-NUGSKGIGSA-N
Mol Weight 472.89 g/mol
Molecular Formula C19H14ClFN8O2S
Exact Mass 472.063299 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Fg9u2LzvxlK
Name 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-N'-[(E)-(2-fluorophenyl)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/C19H14ClFN8O2S/c20-12-5-7-13(8-6-12)32-10-15-16(24-28-29(15)18-17(22)26-31-27-18)19(30)25-23-9-11-3-1-2-4-14(11)21/h1-9H,10H2,(H2,22,26)(H,25,30)/b23-9+
InChIKey XFYSWFUZJXLNKQ-NUGSKGIGSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_13111
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: D79977; Labnumber: NIG2-0372; SBI_ID: SBI-013114
Synonyms 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-N'-[(2-fluorophenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Temperature 315 °C