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

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N'-[(E)-(5-bromo-2-methoxyphenyl)methylidene]-2-{[4-cyclohexyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
SpectraBase Compound ID KrcfCh1MmaA
InChI InChI=1S/C25H28BrN5O2S/c1-17-8-10-18(11-9-17)24-29-30-25(31(24)21-6-4-3-5-7-21)34-16-23(32)28-27-15-19-14-20(26)12-13-22(19)33-2/h8-15,21H,3-7,16H2,1-2H3,(H,28,32)/b27-15+
InChIKey GKVSOKSINOEXBK-JFLMPSFJSA-N
Mol Weight 542.5 g/mol
Molecular Formula C25H28BrN5O2S
Exact Mass 541.114709 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BorBP2dl28N
Name N'-[(E)-(5-bromo-2-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/C25H28BrN5O2S/c1-17-8-10-18(11-9-17)24-29-30-25(31(24)21-6-4-3-5-7-21)34-16-23(32)28-27-15-19-14-20(26)12-13-22(19)33-2/h8-15,21H,3-7,16H2,1-2H3,(H,28,32)/b27-15+
InChIKey GKVSOKSINOEXBK-JFLMPSFJSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_16740
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: D24394; Labnumber: GRES-02372; SBI_ID: SBI-016743
Synonyms N'-[(5-bromo-2-methoxyphenyl)methylidene]-2-{[4-cyclohexyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Temperature 318 °C