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N'-[(E)-(3-bromophenyl)methylidene]-2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide

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N'-[(E)-(3-bromophenyl)methylidene]-2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
SpectraBase Compound ID DodHqH2dzxB
InChI InChI=1S/C28H28BrN5O2S/c1-28(2,3)21-10-8-20(9-11-21)26-32-33-27(34(26)23-12-14-24(36-4)15-13-23)37-18-25(35)31-30-17-19-6-5-7-22(29)16-19/h5-17H,18H2,1-4H3,(H,31,35)/b30-17+
InChIKey XRVKMKOGZJOAGS-OCSSWDANSA-N
Mol Weight 578.53 g/mol
Molecular Formula C28H28BrN5O2S
Exact Mass 577.114709 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID E2ULY99rh9Q
Name N'-[(E)-(3-bromophenyl)methylidene]-2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-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/C28H28BrN5O2S/c1-28(2,3)21-10-8-20(9-11-21)26-32-33-27(34(26)23-12-14-24(36-4)15-13-23)37-18-25(35)31-30-17-19-6-5-7-22(29)16-19/h5-17H,18H2,1-4H3,(H,31,35)/b30-17+
InChIKey XRVKMKOGZJOAGS-OCSSWDANSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_6672
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: D23919; Labnumber: GRES-01643; SBI_ID: SBI-006675
Synonyms N'-[(3-bromophenyl)methylidene]-2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Temperature 318 °C