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N-(2-chloro-4,6-dimethylphenyl)-2-{[5-(2-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID I9tTxgijmV4
InChI InChI=1S/C24H19Cl3N4OS/c1-14-11-15(2)22(20(27)12-14)28-21(32)13-33-24-30-29-23(18-5-3-4-6-19(18)26)31(24)17-9-7-16(25)8-10-17/h3-12H,13H2,1-2H3,(H,28,32)
InChIKey VSSJEAXZJORCQY-UHFFFAOYSA-N
Mol Weight 517.86 g/mol
Molecular Formula C24H19Cl3N4OS
Exact Mass 516.034516 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CYgGk2U1EOn
Name N-(2-chloro-4,6-dimethylphenyl)-2-{[5-(2-chlorophenyl)-4-(4-chlorophenyl)-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/C24H19Cl3N4OS/c1-14-11-15(2)22(20(27)12-14)28-21(32)13-33-24-30-29-23(18-5-3-4-6-19(18)26)31(24)17-9-7-16(25)8-10-17/h3-12H,13H2,1-2H3,(H,28,32)
InChIKey VSSJEAXZJORCQY-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_3855
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: D98142; Labnumber: GRES-16457; SBI_ID: SBI-003857
Temperature 318 °C