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2-{[5-(2-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,5-dichlorophenyl)acetamide

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2-{[5-(2-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,5-dichlorophenyl)acetamide
SpectraBase Compound ID EGvMRnVeVNK
InChI InChI=1S/C22H14Cl4N4OS/c23-13-5-8-15(9-6-13)30-21(16-3-1-2-4-17(16)25)28-29-22(30)32-12-20(31)27-19-11-14(24)7-10-18(19)26/h1-11H,12H2,(H,27,31)
InChIKey SGGNAGXVYIYGNS-UHFFFAOYSA-N
Mol Weight 524.3 g/mol
Molecular Formula C22H14Cl4N4OS
Exact Mass 521.964243 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID C9nzO5UiI5V
Name 2-{[5-(2-chlorophenyl)-4-(4-chlorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,5-dichlorophenyl)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/C22H14Cl4N4OS/c23-13-5-8-15(9-6-13)30-21(16-3-1-2-4-17(16)25)28-29-22(30)32-12-20(31)27-19-11-14(24)7-10-18(19)26/h1-11H,12H2,(H,27,31)
InChIKey SGGNAGXVYIYGNS-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4102
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: D98567; Labnumber: GRES-22818; SBI_ID: SBI-004104
Temperature 318 °C