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

*Links on SpectraBase are not permalinks.

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

View entire compound with spectra: 1 NMR

benzamide, N-[[5-[[2-[4,5-dihydro-5-(4-methylphenyl)-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]methyl]-
SpectraBase Compound ID HLkF5UPf2ui
InChI InChI=1S/C34H32N6O3S2/c1-3-43-27-17-15-26(16-18-27)39-31(21-35-33(42)25-8-5-4-6-9-25)36-37-34(39)45-22-32(41)40-29(24-13-11-23(2)12-14-24)20-28(38-40)30-10-7-19-44-30/h4-19,29H,3,20-22H2,1-2H3,(H,35,42)
InChIKey NCFHRJSRYIRSNI-UHFFFAOYSA-N
Mol Weight 636.8 g/mol
Molecular Formula C34H32N6O3S2
Exact Mass 636.197731 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 3ClK3aSIbtt
Name benzamide, N-[[5-[[2-[4,5-dihydro-5-(4-methylphenyl)-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-(4-ethoxyphenyl)-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/C34H32N6O3S2/c1-3-43-27-17-15-26(16-18-27)39-31(21-35-33(42)25-8-5-4-6-9-25)36-37-34(39)45-22-32(41)40-29(24-13-11-23(2)12-14-24)20-28(38-40)30-10-7-19-44-30/h4-19,29H,3,20-22H2,1-2H3,(H,35,42)
InChIKey NCFHRJSRYIRSNI-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_6098
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/10266694