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acetic acid, [[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-1-(3-bromophenyl)ethylidene]hydrazide

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acetic acid, [[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-1-(3-bromophenyl)ethylidene]hydrazide
SpectraBase Compound ID aabIeK7rxP
InChI InChI=1S/C26H24BrN5O3S/c1-17(18-8-7-9-20(27)14-18)28-29-24(33)16-36-26-31-30-25(32(26)21-10-5-4-6-11-21)19-12-13-22(34-2)23(15-19)35-3/h4-15H,16H2,1-3H3,(H,29,33)/b28-17+
InChIKey PTIGWRXCGHKANT-OGLMXYFKSA-N
Mol Weight 566.47 g/mol
Molecular Formula C26H24BrN5O3S
Exact Mass 565.078324 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HYGmnbn9RjJ
Name acetic acid, [[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]thio]-, 2-[(E)-1-(3-bromophenyl)ethylidene]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/C26H24BrN5O3S/c1-17(18-8-7-9-20(27)14-18)28-29-24(33)16-36-26-31-30-25(32(26)21-10-5-4-6-11-21)19-12-13-22(34-2)23(15-19)35-3/h4-15H,16H2,1-3H3,(H,29,33)/b28-17+
InChIKey PTIGWRXCGHKANT-OGLMXYFKSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_5001
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/10248662