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N-(2-chloro-4,6-dimethylphenyl)-2-{[4-(4-ethoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID CWaMwtfhY6Q
InChI InChI=1S/C27H27ClN4O2S/c1-5-34-22-11-9-21(10-12-22)32-26(20-8-6-7-17(2)14-20)30-31-27(32)35-16-24(33)29-25-19(4)13-18(3)15-23(25)28/h6-15H,5,16H2,1-4H3,(H,29,33)
InChIKey ZZTWWAPOEKTYGD-UHFFFAOYSA-N
Mol Weight 507.05 g/mol
Molecular Formula C27H27ClN4O2S
Exact Mass 506.154325 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9ETStyuYsI7
Name N-(2-chloro-4,6-dimethylphenyl)-2-{[4-(4-ethoxyphenyl)-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
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/C27H27ClN4O2S/c1-5-34-22-11-9-21(10-12-22)32-26(20-8-6-7-17(2)14-20)30-31-27(32)35-16-24(33)29-25-19(4)13-18(3)15-23(25)28/h6-15H,5,16H2,1-4H3,(H,29,33)
InChIKey ZZTWWAPOEKTYGD-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4924
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: E08376; Labnumber: GRES-36989; SBI_ID: SBI-004926
Temperature 308 °C