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

*Links on SpectraBase are not permalinks.

benzamide, 3-fluoro-N-[[5-[[2-[5-(4-fluorophenyl)-4,5-dihydro-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-methyl-4H-1,2,4-triazol-3-yl]methyl]-

View entire compound with spectra: 1 NMR

benzamide, 3-fluoro-N-[[5-[[2-[5-(4-fluorophenyl)-4,5-dihydro-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-methyl-4H-1,2,4-triazol-3-yl]methyl]-
SpectraBase Compound ID 5laAvZdhiAS
InChI InChI=1S/C26H22F2N6O2S2/c1-33-23(14-29-25(36)17-4-2-5-19(28)12-17)30-31-26(33)38-15-24(35)34-21(16-7-9-18(27)10-8-16)13-20(32-34)22-6-3-11-37-22/h2-12,21H,13-15H2,1H3,(H,29,36)
InChIKey JNLYHARILLTBAV-UHFFFAOYSA-N
Mol Weight 552.62 g/mol
Molecular Formula C26H22F2N6O2S2
Exact Mass 552.121373 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 Hu8DHuDwz1i
Name benzamide, 3-fluoro-N-[[5-[[2-[5-(4-fluorophenyl)-4,5-dihydro-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-methyl-4H-1,2,4-triazol-3-yl]methyl]-
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/C26H22F2N6O2S2/c1-33-23(14-29-25(36)17-4-2-5-19(28)12-17)30-31-26(33)38-15-24(35)34-21(16-7-9-18(27)10-8-16)13-20(32-34)22-6-3-11-37-22/h2-12,21H,13-15H2,1H3,(H,29,36)
InChIKey JNLYHARILLTBAV-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_5445
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: NMR/10257097; Labnumber: F0514-0570