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N'-[(E)-(2,6-dichlorophenyl)methylidene]-2-{[1-(4-methylbenzyl)-1H-benzimidazol-2-yl]sulfanyl}acetohydrazide
SpectraBase Compound ID IfPJ5o3B7KC
InChI InChI=1S/C24H20Cl2N4OS/c1-16-9-11-17(12-10-16)14-30-22-8-3-2-7-21(22)28-24(30)32-15-23(31)29-27-13-18-19(25)5-4-6-20(18)26/h2-13H,14-15H2,1H3,(H,29,31)/b27-13+
InChIKey YZQNHRZPTVVVDQ-UVHMKAGCSA-N
Mol Weight 483.42 g/mol
Molecular Formula C24H20Cl2N4OS
Exact Mass 482.073488 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E3j4QZbCHuQ
Name N'-[(E)-(2,6-dichlorophenyl)methylidene]-2-{[1-(4-methylbenzyl)-1H-benzimidazol-2-yl]sulfanyl}acetohydrazide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 482.073487853 u
Formula C24H20Cl2N4OS
InChI InChI=1S/C24H20Cl2N4OS/c1-16-9-11-17(12-10-16)14-30-22-8-3-2-7-21(22)28-24(30)32-15-23(31)29-27-13-18-19(25)5-4-6-20(18)26/h2-13H,14-15H2,1H3,(H,29,31)/b27-13+
InChIKey YZQNHRZPTVVVDQ-UVHMKAGCSA-N
Molecular Weight 483.417 g/mol
SMILES N(\N=C\C1=C(Cl)C=CC=C1Cl)C(CSC=1N(C=2C=CC=CC2N1)CC1=CC=C(C=C1)C)=O