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

View entire compound with spectra: 1 NMR

2-({5-[(4-chlorophenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,4-dimethylphenyl)acetamide
SpectraBase Compound ID JqwktboWBSL
InChI InChI=1S/C25H23ClN4O2S/c1-17-8-13-22(18(2)14-17)27-24(31)16-33-25-29-28-23(30(25)20-6-4-3-5-7-20)15-32-21-11-9-19(26)10-12-21/h3-14H,15-16H2,1-2H3,(H,27,31)
InChIKey JCZPRXOJLLTBKI-UHFFFAOYSA-N
Mol Weight 479.0 g/mol
Molecular Formula C25H23ClN4O2S
Exact Mass 478.123025 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5Sx0DgYCYo1
Name 2-({5-[(4-chlorophenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2,4-dimethylphenyl)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/C25H23ClN4O2S/c1-17-8-13-22(18(2)14-17)27-24(31)16-33-25-29-28-23(30(25)20-6-4-3-5-7-20)15-32-21-11-9-19(26)10-12-21/h3-14H,15-16H2,1-2H3,(H,27,31)
InChIKey JCZPRXOJLLTBKI-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_4286
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/8116926; UBI_ID: UBI-004287
Temperature 308 °C