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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]-3,5-dimethoxy-

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]-3,5-dimethoxy-
SpectraBase Compound ID L6STNcYPeMR
InChI InChI=1S/C36H36N6O5S2/c1-5-47-27-14-12-26(13-15-27)41-33(21-37-35(44)25-17-28(45-3)19-29(18-25)46-4)38-39-36(41)49-22-34(43)42-31(24-10-8-23(2)9-11-24)20-30(40-42)32-7-6-16-48-32/h6-19,31H,5,20-22H2,1-4H3,(H,37,44)
InChIKey XRGILEZUTYZLSS-UHFFFAOYSA-N
Mol Weight 696.8 g/mol
Molecular Formula C36H36N6O5S2
Exact Mass 696.218861 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Fw561kAO2DM
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]-3,5-dimethoxy-
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/C36H36N6O5S2/c1-5-47-27-14-12-26(13-15-27)41-33(21-37-35(44)25-17-28(45-3)19-29(18-25)46-4)38-39-36(41)49-22-34(43)42-31(24-10-8-23(2)9-11-24)20-30(40-42)32-7-6-16-48-32/h6-19,31H,5,20-22H2,1-4H3,(H,37,44)
InChIKey XRGILEZUTYZLSS-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_6126
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/10266729