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

View entire compound with spectra: 1 NMR

2-{[5-[(4-chlorophenoxy)methyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-fluorophenyl)acetamide
SpectraBase Compound ID EzgAGs2xfEM
InChI InChI=1S/C24H20ClFN4O3S/c1-32-18-12-8-17(9-13-18)30-22(14-33-19-10-6-16(25)7-11-19)28-29-24(30)34-15-23(31)27-21-5-3-2-4-20(21)26/h2-13H,14-15H2,1H3,(H,27,31)
InChIKey HBVAPPAPZDDLRI-UHFFFAOYSA-N
Mol Weight 498.96 g/mol
Molecular Formula C24H20ClFN4O3S
Exact Mass 498.092868 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IOHbqlrixIS
Name 2-{[5-[(4-chlorophenoxy)methyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-fluorophenyl)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/C24H20ClFN4O3S/c1-32-18-12-8-17(9-13-18)30-22(14-33-19-10-6-16(25)7-11-19)28-29-24(30)34-15-23(31)27-21-5-3-2-4-20(21)26/h2-13H,14-15H2,1H3,(H,27,31)
InChIKey HBVAPPAPZDDLRI-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11241
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: E06525; Labnumber: GRES-24099; SBI_ID: SBI-011244
Temperature 315 °C