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2-{[5-(anilinomethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
SpectraBase Compound ID HaTqGcpVkDl
InChI InChI=1S/C24H23N5O2S/c1-31-21-14-12-19(13-15-21)26-23(30)17-32-24-28-27-22(16-25-18-8-4-2-5-9-18)29(24)20-10-6-3-7-11-20/h2-15,25H,16-17H2,1H3,(H,26,30)
InChIKey XGWNUVNDZHUTIC-UHFFFAOYSA-N
Mol Weight 445.54 g/mol
Molecular Formula C24H23N5O2S
Exact Mass 445.157246 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2IZWGkJaJbu
Name 2-{[5-(anilinomethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-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/C24H23N5O2S/c1-31-21-14-12-19(13-15-21)26-23(30)17-32-24-28-27-22(16-25-18-8-4-2-5-9-18)29(24)20-10-6-3-7-11-20/h2-15,25H,16-17H2,1H3,(H,26,30)
InChIKey XGWNUVNDZHUTIC-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_3610
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/8097137; UBI_ID: UBI-003611
Temperature 308 °C