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

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2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxyphenyl)acetamide
SpectraBase Compound ID DX4DffDz5Aj
InChI InChI=1S/C20H22N4O3S/c1-4-24-19(14-9-11-15(26-2)12-10-14)22-23-20(24)28-13-18(25)21-16-7-5-6-8-17(16)27-3/h5-12H,4,13H2,1-3H3,(H,21,25)
InChIKey MSPQTCJWMKRCBL-UHFFFAOYSA-N
Mol Weight 398.48 g/mol
Molecular Formula C20H22N4O3S
Exact Mass 398.141262 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9rLJFoA3ont
Name 2-{[4-ethyl-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxyphenyl)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/C20H22N4O3S/c1-4-24-19(14-9-11-15(26-2)12-10-14)22-23-20(24)28-13-18(25)21-16-7-5-6-8-17(16)27-3/h5-12H,4,13H2,1-3H3,(H,21,25)
InChIKey MSPQTCJWMKRCBL-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14348
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: D98238; Labnumber: GRES-17799; SBI_ID: SBI-014351
Temperature 308 °C