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acetamide, N-(4-methoxyphenyl)-2-[[4-(2-methylphenyl)-5-[[(4-methylphenyl)amino]methyl]-4H-1,2,4-triazol-3-yl]thio]-
SpectraBase Compound ID JstijKLI7jF
InChI InChI=1S/C26H27N5O2S/c1-18-8-10-20(11-9-18)27-16-24-29-30-26(31(24)23-7-5-4-6-19(23)2)34-17-25(32)28-21-12-14-22(33-3)15-13-21/h4-15,27H,16-17H2,1-3H3,(H,28,32)
InChIKey KJSPYQSUEJFTGE-UHFFFAOYSA-N
Mol Weight 473.6 g/mol
Molecular Formula C26H27N5O2S
Exact Mass 473.188546 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 58RAcLqrahy
Name acetamide, N-(4-methoxyphenyl)-2-[[4-(2-methylphenyl)-5-[[(4-methylphenyl)amino]methyl]-4H-1,2,4-triazol-3-yl]thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 473.188546301 u
Formula C26H27N5O2S
InChI InChI=1S/C26H27N5O2S/c1-18-8-10-20(11-9-18)27-16-24-29-30-26(31(24)23-7-5-4-6-19(23)2)34-17-25(32)28-21-12-14-22(33-3)15-13-21/h4-15,27H,16-17H2,1-3H3,(H,28,32)
InChIKey KJSPYQSUEJFTGE-UHFFFAOYSA-N
Molecular Weight 473.595 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_18228
Solvent DMSO-d6
Source Vendor ID: NMR/10321038; Lab Info: DEM; Lab Number: DEM-0000148