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4-{[(E)-(4-chlorophenyl)methylidene]amino}-5-(4-ethoxyphenyl)-4H-1,2,4-triazole-3-thiol
SpectraBase Compound ID ERyz4UcKtUq
InChI InChI=1S/C17H15ClN4OS/c1-2-23-15-9-5-13(6-10-15)16-20-21-17(24)22(16)19-11-12-3-7-14(18)8-4-12/h3-11H,2H2,1H3,(H,21,24)/b19-11+
InChIKey LQJIHZCKGBAATM-YBFXNURJSA-N
Mol Weight 358.85 g/mol
Molecular Formula C17H15ClN4OS
Exact Mass 358.06551 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FTOIn5XI42M
Name 4-{[(E)-(4-chlorophenyl)methylidene]amino}-5-(4-ethoxyphenyl)-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/C17H15ClN4OS/c1-2-23-15-9-5-13(6-10-15)16-20-21-17(24)22(16)19-11-12-3-7-14(18)8-4-12/h3-11H,2H2,1H3,(H,21,24)/b19-11+
InChIKey LQJIHZCKGBAATM-YBFXNURJSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_17044
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: D25416; Labnumber: GRES-03657; SBI_ID: SBI-017047
Synonyms 4-{[(E)-(4-chlorophenyl)methylidene]amino}-5-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl hydrosulfide4-{[(4-chlorophenyl)methylidene]amino}-5-(4-ethoxyphenyl)-4H-1,2,4-triazole-3-thiol
Temperature 308 °C