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1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3-methyl-2-thienyl)methylidene]-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide

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1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3-methyl-2-thienyl)methylidene]-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
SpectraBase Compound ID 4fgArC9mxA9
InChI InChI=1S/C17H13N9O4S/c1-9-6-7-31-12(9)8-19-21-17(27)13-14(10-2-4-11(5-3-10)26(28)29)25(24-20-13)16-15(18)22-30-23-16/h2-8H,1H3,(H2,18,22)(H,21,27)/b19-8+
InChIKey KTVQPLWFMYECPK-UFWORHAWSA-N
Mol Weight 439.41 g/mol
Molecular Formula C17H13N9O4S
Exact Mass 439.081121 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3ONrhvMG1vV
Name 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3-methyl-2-thienyl)methylidene]-5-(4-nitrophenyl)-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/C17H13N9O4S/c1-9-6-7-31-12(9)8-19-21-17(27)13-14(10-2-4-11(5-3-10)26(28)29)25(24-20-13)16-15(18)22-30-23-16/h2-8H,1H3,(H2,18,22)(H,21,27)/b19-8+
InChIKey KTVQPLWFMYECPK-UFWORHAWSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_23263
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: D37333; Labnumber: NIG1-2704; SBI_ID: SBI-023267
Synonyms 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(3-methyl-2-thienyl)methylidene]-5-(4-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Temperature 315 °C