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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-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]methyl]-3,5-dimethoxy-
SpectraBase Compound ID A3Q0iaDBqUN
InChI InChI=1S/C35H34N6O4S2/c1-22-10-12-24(13-11-22)30-19-29(31-9-6-14-46-31)39-41(30)33(42)21-47-35-38-37-32(40(35)26-8-5-7-23(2)15-26)20-36-34(43)25-16-27(44-3)18-28(17-25)45-4/h5-18,30H,19-21H2,1-4H3,(H,36,43)
InChIKey ZJLGUNCGSGIQPY-UHFFFAOYSA-N
Mol Weight 666.8 g/mol
Molecular Formula C35H34N6O4S2
Exact Mass 666.208296 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JoUFgdEmVrg
Name benzamide, N-[[5-[[2-[4,5-dihydro-5-(4-methylphenyl)-3-(2-thienyl)-1H-pyrazol-1-yl]-2-oxoethyl]thio]-4-(3-methylphenyl)-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/C35H34N6O4S2/c1-22-10-12-24(13-11-22)30-19-29(31-9-6-14-46-31)39-41(30)33(42)21-47-35-38-37-32(40(35)26-8-5-7-23(2)15-26)20-36-34(43)25-16-27(44-3)18-28(17-25)45-4/h5-18,30H,19-21H2,1-4H3,(H,36,43)
InChIKey ZJLGUNCGSGIQPY-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_8313_6123
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/10266726