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

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N-(2,5-dimethylphenyl)-2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID GSqPjCBjBXv
InChI InChI=1S/C21H24N4O2S/c1-5-25-20(16-8-10-17(27-4)11-9-16)23-24-21(25)28-13-19(26)22-18-12-14(2)6-7-15(18)3/h6-12H,5,13H2,1-4H3,(H,22,26)
InChIKey YSDKDZXXZWBGFO-UHFFFAOYSA-N
Mol Weight 396.51 g/mol
Molecular Formula C21H24N4O2S
Exact Mass 396.161997 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IZNF0JjRCj4
Name N-(2,5-dimethylphenyl)-2-{[4-ethyl-5-(4-methoxyphenyl)-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/C21H24N4O2S/c1-5-25-20(16-8-10-17(27-4)11-9-16)23-24-21(25)28-13-19(26)22-18-12-14(2)6-7-15(18)3/h6-12H,5,13H2,1-4H3,(H,22,26)
InChIKey YSDKDZXXZWBGFO-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14559
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: D98695; Labnumber: GRES-25095; SBI_ID: SBI-014562
Temperature 308 °C