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2-{[5-(4-methoxyphenyl)-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methylphenyl)acetamide

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2-{[5-(4-methoxyphenyl)-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methylphenyl)acetamide
SpectraBase Compound ID 85rkwDHkZUp
InChI InChI=1S/C25H24N4O2S/c1-17-8-12-20(13-9-17)26-23(30)16-32-25-28-27-24(19-10-14-21(31-3)15-11-19)29(25)22-7-5-4-6-18(22)2/h4-15H,16H2,1-3H3,(H,26,30)
InChIKey NZJNKJUDDKKNFQ-UHFFFAOYSA-N
Mol Weight 444.55 g/mol
Molecular Formula C25H24N4O2S
Exact Mass 444.161997 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DVAfc90vIK7
Name 2-{[5-(4-methoxyphenyl)-4-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methylphenyl)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/C25H24N4O2S/c1-17-8-12-20(13-9-17)26-23(30)16-32-25-28-27-24(19-10-14-21(31-3)15-11-19)29(25)22-7-5-4-6-18(22)2/h4-15H,16H2,1-3H3,(H,26,30)
InChIKey NZJNKJUDDKKNFQ-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_5560
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: NMR/11221798; Labnumber: 0763; IOH_ID: IOH-005561