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benzamide, N-[[5-[[2-[5-(2,3-dimethoxyphenyl)-4,5-dihydro-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]methyl]-2-methoxy-
SpectraBase Compound ID F62Hv8PqWP1
InChI InChI=1S/C35H34N6O5S2/c1-22-10-7-11-23(18-22)40-31(20-36-34(43)25-12-5-6-14-28(25)44-2)37-38-35(40)48-21-32(42)41-27(19-26(39-41)30-16-9-17-47-30)24-13-8-15-29(45-3)33(24)46-4/h5-18,27H,19-21H2,1-4H3,(H,36,43)
InChIKey LFZQUFNLGSREBG-UHFFFAOYSA-N
Mol Weight 682.8 g/mol
Molecular Formula C35H34N6O5S2
Exact Mass 682.203211 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID J4hHBj1r0vT
Name benzamide, N-[[5-[[2-[5-(2,3-dimethoxyphenyl)-4,5-dihydro-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]methyl]-2-methoxy-
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/C35H34N6O5S2/c1-22-10-7-11-23(18-22)40-31(20-36-34(43)25-12-5-6-14-28(25)44-2)37-38-35(40)48-21-32(42)41-27(19-26(39-41)30-16-9-17-47-30)24-13-8-15-29(45-3)33(24)46-4/h5-18,27H,19-21H2,1-4H3,(H,36,43)
InChIKey LFZQUFNLGSREBG-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_5521
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/10257204; Labnumber: F0514-0840