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2-{[4-ethyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-fluoro-4-methylphenyl)acetamide
SpectraBase Compound ID mRNZROOLsx
InChI InChI=1S/C20H21FN4OS/c1-4-25-19(15-8-5-13(2)6-9-15)23-24-20(25)27-12-18(26)22-16-10-7-14(3)17(21)11-16/h5-11H,4,12H2,1-3H3,(H,22,26)
InChIKey MMIKNSLYAUBPQW-UHFFFAOYSA-N
Mol Weight 384.47 g/mol
Molecular Formula C20H21FN4OS
Exact Mass 384.142011 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7fvHJFB7MdU
Name 2-{[4-ethyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-fluoro-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/C20H21FN4OS/c1-4-25-19(15-8-5-13(2)6-9-15)23-24-20(25)27-12-18(26)22-16-10-7-14(3)17(21)11-16/h5-11H,4,12H2,1-3H3,(H,22,26)
InChIKey MMIKNSLYAUBPQW-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4537
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: D99134; Labnumber: GRES-32050; SBI_ID: SBI-004539
Temperature 315 °C