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4-{[(E)-(4-ethoxy-3-methoxyphenyl)methylidene]amino}-5-(2-pyridinyl)-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID GKWazjPy4he
InChI InChI=1S/C17H17N5O2S/c1-3-24-14-8-7-12(10-15(14)23-2)11-19-22-16(20-21-17(22)25)13-6-4-5-9-18-13/h4-11H,3H2,1-2H3,(H,21,25)/b19-11+
InChIKey LSIXSRZZYQZBEP-YBFXNURJSA-N
Mol Weight 355.42 g/mol
Molecular Formula C17H17N5O2S
Exact Mass 355.110296 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4QjTNjDDOkV
Name 4-{[(E)-(4-ethoxy-3-methoxyphenyl)methylidene]amino}-5-(2-pyridinyl)-4H-1,2,4-triazole-3-thiol
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/C17H17N5O2S/c1-3-24-14-8-7-12(10-15(14)23-2)11-19-22-16(20-21-17(22)25)13-6-4-5-9-18-13/h4-11H,3H2,1-2H3,(H,21,25)/b19-11+
InChIKey LSIXSRZZYQZBEP-YBFXNURJSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_16753
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: D24850; Labnumber: GRES-02861; SBI_ID: SBI-016756
Synonyms 4-{[(E)-(4-ethoxy-3-methoxyphenyl)methylidene]amino}-5-(2-pyridinyl)-4H-1,2,4-triazol-3-yl hydrosulfide4-{[(4-ethoxy-3-methoxyphenyl)methylidene]amino}-5-(2-pyridinyl)-4H-1,2,4-triazole-3-thiol
Temperature 315 °C