For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

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

View entire compound with spectra: 1 NMR

2-{[4-(4-fluorophenyl)-5-(2-thienyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
SpectraBase Compound ID KHYbtShfVAi
InChI InChI=1S/C21H17FN4O2S2/c1-28-17-10-6-15(7-11-17)23-19(27)13-30-21-25-24-20(18-3-2-12-29-18)26(21)16-8-4-14(22)5-9-16/h2-12H,13H2,1H3,(H,23,27)
InChIKey ZTXUJCHLNJMURQ-UHFFFAOYSA-N
Mol Weight 440.51 g/mol
Molecular Formula C21H17FN4O2S2
Exact Mass 440.077696 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID CYuWYqM49Ii
Name 2-{[4-(4-fluorophenyl)-5-(2-thienyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-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/C21H17FN4O2S2/c1-28-17-10-6-15(7-11-17)23-19(27)13-30-21-25-24-20(18-3-2-12-29-18)26(21)16-8-4-14(22)5-9-16/h2-12H,13H2,1H3,(H,23,27)
InChIKey ZTXUJCHLNJMURQ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_24878
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: D48640; Labnumber: VGU-0022755; SBI_ID: SBI-024882
Temperature 308 °C