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acetic acid, [[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-(4-propoxyphenyl)methylidene]hydrazide

View entire compound with spectra: 1 NMR

acetic acid, [[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-(4-propoxyphenyl)methylidene]hydrazide
SpectraBase Compound ID JmwsX9CdINo
InChI InChI=1S/C27H26ClN5O2S/c1-3-16-35-24-14-6-20(7-15-24)17-29-30-25(34)18-36-27-32-31-26(21-8-10-22(28)11-9-21)33(27)23-12-4-19(2)5-13-23/h4-15,17H,3,16,18H2,1-2H3,(H,30,34)/b29-17+
InChIKey PZEKXBNCSVRUIE-STBIYBPSSA-N
Mol Weight 520.05 g/mol
Molecular Formula C27H26ClN5O2S
Exact Mass 519.149574 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9VhAYe3bKcz
Name acetic acid, [[5-(4-chlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-(4-propoxyphenyl)methylidene]hydrazide
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/C27H26ClN5O2S/c1-3-16-35-24-14-6-20(7-15-24)17-29-30-25(34)18-36-27-32-31-26(21-8-10-22(28)11-9-21)33(27)23-12-4-19(2)5-13-23/h4-15,17H,3,16,18H2,1-2H3,(H,30,34)/b29-17+
InChIKey PZEKXBNCSVRUIE-STBIYBPSSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_5800
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: NMR/10259194