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1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-methylphenyl)sulfanyl]methyl}-N'-[(E)-3-pyridinylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
SpectraBase Compound ID HFva9WyOlGW
InChI InChI=1S/C19H17N9O2S/c1-12-4-6-14(7-5-12)31-11-15-16(23-27-28(15)18-17(20)25-30-26-18)19(29)24-22-10-13-3-2-8-21-9-13/h2-10H,11H2,1H3,(H2,20,25)(H,24,29)/b22-10+
InChIKey WSBGFEUAPWRWIZ-LSHDLFTRSA-N
Mol Weight 435.47 g/mol
Molecular Formula C19H17N9O2S
Exact Mass 435.122592 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6yHd0UhBlKZ
Name 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-methylphenyl)sulfanyl]methyl}-N'-[(E)-3-pyridinylmethylidene]-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/C19H17N9O2S/c1-12-4-6-14(7-5-12)31-11-15-16(23-27-28(15)18-17(20)25-30-26-18)19(29)24-22-10-13-3-2-8-21-9-13/h2-10H,11H2,1H3,(H2,20,25)(H,24,29)/b22-10+
InChIKey WSBGFEUAPWRWIZ-LSHDLFTRSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_28129
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: D80453; Labnumber: NIG2-2940; SBI_ID: SBI-028133
Synonyms 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-methylphenyl)sulfanyl]methyl}-N'-[3-pyridinylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Temperature 308 °C