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2-{[4-ethyl-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-ethylphenyl)acetamide
SpectraBase Compound ID m2PtZwOusd
InChI InChI=1S/C21H24N4O2S/c1-4-15-9-11-17(12-10-15)22-19(26)14-28-21-24-23-20(25(21)5-2)16-7-6-8-18(13-16)27-3/h6-13H,4-5,14H2,1-3H3,(H,22,26)
InChIKey IYNWOUNTKUURBI-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 CEWTvQWwXjm
Name 2-{[4-ethyl-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-ethylphenyl)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/c1-4-15-9-11-17(12-10-15)22-19(26)14-28-21-24-23-20(25(21)5-2)16-7-6-8-18(13-16)27-3/h6-13H,4-5,14H2,1-3H3,(H,22,26)
InChIKey IYNWOUNTKUURBI-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11454
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: E06352; Labnumber: GRES-21169; SBI_ID: SBI-011457
Temperature 308 °C