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1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2-thienyl)-N'-{(E)-[4-(trifluoromethyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide

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1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2-thienyl)-N'-{(E)-[4-(trifluoromethyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
SpectraBase Compound ID 9ffgvM4pvmk
InChI InChI=1S/C17H11F3N8O2S/c18-17(19,20)10-5-3-9(4-6-10)8-22-24-16(29)12-13(11-2-1-7-31-11)28(27-23-12)15-14(21)25-30-26-15/h1-8H,(H2,21,25)(H,24,29)/b22-8+
InChIKey XZWFNJREUIAWPK-GZIVZEMBSA-N
Mol Weight 448.38 g/mol
Molecular Formula C17H11F3N8O2S
Exact Mass 448.067777 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3O1bYZmIysu
Name 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2-thienyl)-N'-{(E)-[4-(trifluoromethyl)phenyl]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/C17H11F3N8O2S/c18-17(19,20)10-5-3-9(4-6-10)8-22-24-16(29)12-13(11-2-1-7-31-11)28(27-23-12)15-14(21)25-30-26-15/h1-8H,(H2,21,25)(H,24,29)/b22-8+
InChIKey XZWFNJREUIAWPK-GZIVZEMBSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_28866
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: D90177; Labnumber: MROZ-1439; SBI_ID: SBI-028870
Synonyms 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2-thienyl)-N'-{[4-(trifluoromethyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Temperature 306 °C