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4-{[(E)-(4-ethoxy-3-methoxyphenyl)methylidene]amino}-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID 2OwhQNfDM3R
InChI InChI=1S/C16H18N6O2S/c1-4-24-13-6-5-11(8-14(13)23-3)9-17-22-15(20-21-16(22)25)12-7-10(2)18-19-12/h5-9H,4H2,1-3H3,(H,18,19)(H,21,25)/b17-9+
InChIKey AZGFYWQIPDQDSI-RQZCQDPDSA-N
Mol Weight 358.42 g/mol
Molecular Formula C16H18N6O2S
Exact Mass 358.121195 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KyXdabpyESl
Name 4-{[(E)-(4-ethoxy-3-methoxyphenyl)methylidene]amino}-5-(3-methyl-1H-pyrazol-5-yl)-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/C16H18N6O2S/c1-4-24-13-6-5-11(8-14(13)23-3)9-17-22-15(20-21-16(22)25)12-7-10(2)18-19-12/h5-9H,4H2,1-3H3,(H,18,19)(H,21,25)/b17-9+
InChIKey AZGFYWQIPDQDSI-RQZCQDPDSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_10531
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: E00582; Labnumber: GRES-15663; SBI_ID: SBI-010534
Synonyms 4-{[(E)-(4-ethoxy-3-methoxyphenyl)methylidene]amino}-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-yl hydrosulfide4-{[(4-ethoxy-3-methoxyphenyl)methylidene]amino}-5-(3-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazole-3-thiol
Temperature 318 °C