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

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2-{[5-(2-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-difluorophenyl)acetamide
SpectraBase Compound ID 1sYlKAjdBNf
InChI InChI=1S/C22H15ClF2N4OS/c23-17-9-5-4-8-16(17)21-27-28-22(29(21)15-6-2-1-3-7-15)31-13-20(30)26-19-11-10-14(24)12-18(19)25/h1-12H,13H2,(H,26,30)
InChIKey WOKGIECFDBYFPM-UHFFFAOYSA-N
Mol Weight 456.9 g/mol
Molecular Formula C22H15ClF2N4OS
Exact Mass 456.062316 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DZQgzd3FqJ
Name 2-{[5-(2-chlorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-difluorophenyl)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/C22H15ClF2N4OS/c23-17-9-5-4-8-16(17)21-27-28-22(29(21)15-6-2-1-3-7-15)31-13-20(30)26-19-11-10-14(24)12-18(19)25/h1-12H,13H2,(H,26,30)
InChIKey WOKGIECFDBYFPM-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_2584
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: UZI/8058305; UBI_ID: UBI-002585
Temperature 308 °C