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N-(2-ethylphenyl)-2-({4-(4-methoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
SpectraBase Compound ID Gu0LEV8eoYH
InChI InChI=1S/C27H28N4O3S/c1-4-20-7-5-6-8-24(20)28-26(32)18-35-27-30-29-25(17-34-23-13-9-19(2)10-14-23)31(27)21-11-15-22(33-3)16-12-21/h5-16H,4,17-18H2,1-3H3,(H,28,32)
InChIKey LCRTUSQXJNNHDG-UHFFFAOYSA-N
Mol Weight 488.61 g/mol
Molecular Formula C27H28N4O3S
Exact Mass 488.188212 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BzJ9mheTGv3
Name N-(2-ethylphenyl)-2-({4-(4-methoxyphenyl)-5-[(4-methylphenoxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)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/C27H28N4O3S/c1-4-20-7-5-6-8-24(20)28-26(32)18-35-27-30-29-25(17-34-23-13-9-19(2)10-14-23)31(27)21-11-15-22(33-3)16-12-21/h5-16H,4,17-18H2,1-3H3,(H,28,32)
InChIKey LCRTUSQXJNNHDG-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11247
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: E06531; Labnumber: GRES-24216; SBI_ID: SBI-011250
Temperature 315 °C