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

View entire compound with spectra: 2 NMR

N'-[(E)-(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-2-{[4-(4-chlorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
SpectraBase Compound ID AMLJ2LDMBxx
InChI InChI=1S/C24H19BrClN5O3S/c1-34-20-12-15(11-19(25)22(20)33)13-27-28-21(32)14-35-24-30-29-23(16-5-3-2-4-6-16)31(24)18-9-7-17(26)8-10-18/h2-13,33H,14H2,1H3,(H,28,32)/b27-13+
InChIKey DUZOWZZWTOFDRH-UVHMKAGCSA-N
Mol Weight 572.87 g/mol
Molecular Formula C24H19BrClN5O3S
Exact Mass 571.008051 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DjLP3U3tDN8
Name N'-[(E)-(3-bromo-4-hydroxy-5-methoxyphenyl)methylidene]-2-{[4-(4-chlorophenyl)-5-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 571.008051363 u
Formula C24H19BrClN5O3S
InChI InChI=1S/C24H19BrClN5O3S/c1-34-20-12-15(11-19(25)22(20)33)13-27-28-21(32)14-35-24-30-29-23(16-5-3-2-4-6-16)31(24)18-9-7-17(26)8-10-18/h2-13,33H,14H2,1H3,(H,28,32)/b27-13+
InChIKey DUZOWZZWTOFDRH-UVHMKAGCSA-N
Molecular Weight 572.865 g/mol
SMILES N(\N=C\C=1C=C(C(=C(C1)Br)O)OC)C(CSC=1N(C(=NN1)C1=CC=CC=C1)C1=CC=C(C=C1)Cl)=O