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2-{[5-(4-bromophenyl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-ethoxyphenyl)acetamide
SpectraBase Compound ID AumRHqsuFYm
InChI InChI=1S/C25H23BrN4O2S/c1-3-32-22-13-11-20(12-14-22)27-23(31)16-33-25-29-28-24(18-7-9-19(26)10-8-18)30(25)21-6-4-5-17(2)15-21/h4-15H,3,16H2,1-2H3,(H,27,31)
InChIKey PTVZQASKVIKMOL-UHFFFAOYSA-N
Mol Weight 523.45 g/mol
Molecular Formula C25H23BrN4O2S
Exact Mass 522.07251 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JiPjpBVBkW7
Name 2-{[5-(4-bromophenyl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-ethoxyphenyl)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/C25H23BrN4O2S/c1-3-32-22-13-11-20(12-14-22)27-23(31)16-33-25-29-28-24(18-7-9-19(26)10-8-18)30(25)21-6-4-5-17(2)15-21/h4-15H,3,16H2,1-2H3,(H,27,31)
InChIKey PTVZQASKVIKMOL-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_5960
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: 121869; Labnumber: EX00112281; VK_ID: VK-005963
Temperature 308 °C