For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

N'-[(E)-(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-2-{[4-cyclohexyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide

View entire compound with spectra: 1 NMR

N'-[(E)-(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-2-{[4-cyclohexyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
SpectraBase Compound ID IW7A8cI5fsB
InChI InChI=1S/C25H28BrN5O3S/c1-16-8-10-18(11-9-16)24-29-30-25(31(24)19-6-4-3-5-7-19)35-15-22(32)28-27-14-17-12-20(26)23(33)21(13-17)34-2/h8-14,19,33H,3-7,15H2,1-2H3,(H,28,32)/b27-14+
InChIKey BGKBGIOYIMPMQO-MZJWZYIUSA-N
Mol Weight 558.5 g/mol
Molecular Formula C25H28BrN5O3S
Exact Mass 557.109624 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID LIE6It135Yt
Name N'-[(E)-(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-2-{[4-cyclohexyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
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/C25H28BrN5O3S/c1-16-8-10-18(11-9-16)24-29-30-25(31(24)19-6-4-3-5-7-19)35-15-22(32)28-27-14-17-12-20(26)23(33)21(13-17)34-2/h8-14,19,33H,3-7,15H2,1-2H3,(H,28,32)/b27-14+
InChIKey BGKBGIOYIMPMQO-MZJWZYIUSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_6784
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: D24464; Labnumber: GRES-02450; SBI_ID: SBI-006787
Synonyms N'-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-2-{[4-cyclohexyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Temperature 308 °C