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2-({5-[(4-chlorophenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-methoxyphenyl)acetamide
SpectraBase Compound ID BhtxydOUycY
InChI InChI=1S/C24H21ClN4O3S/c1-31-21-10-6-5-9-20(21)26-23(30)16-33-24-28-27-22(29(24)18-7-3-2-4-8-18)15-32-19-13-11-17(25)12-14-19/h2-14H,15-16H2,1H3,(H,26,30)
InChIKey BQKVMBGVRULMBX-UHFFFAOYSA-N
Mol Weight 480.97 g/mol
Molecular Formula C24H21ClN4O3S
Exact Mass 480.102289 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Jhr9D1qG6rj
Name 2-({5-[(4-chlorophenoxy)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(2-methoxyphenyl)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/C24H21ClN4O3S/c1-31-21-10-6-5-9-20(21)26-23(30)16-33-24-28-27-22(29(24)18-7-3-2-4-8-18)15-32-19-13-11-17(25)12-14-19/h2-14H,15-16H2,1H3,(H,26,30)
InChIKey BQKVMBGVRULMBX-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_4401
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/8119306; UBI_ID: UBI-004402
Temperature 308 °C