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N-(2,6-dimethylphenyl)-2-{[4-phenyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID IT8rbvjiDMi
InChI InChI=1S/C23H21N5OS/c1-16-7-6-8-17(2)21(16)25-20(29)15-30-23-27-26-22(18-11-13-24-14-12-18)28(23)19-9-4-3-5-10-19/h3-14H,15H2,1-2H3,(H,25,29)
InChIKey ONHWSZIYZWNOFV-UHFFFAOYSA-N
Mol Weight 415.52 g/mol
Molecular Formula C23H21N5OS
Exact Mass 415.146681 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HC6OPKFL2hW
Name N-(2,6-dimethylphenyl)-2-{[4-phenyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 415.146681489 u
Formula C23H21N5OS
InChI InChI=1S/C23H21N5OS/c1-16-7-6-8-17(2)21(16)25-20(29)15-30-23-27-26-22(18-11-13-24-14-12-18)28(23)19-9-4-3-5-10-19/h3-14H,15H2,1-2H3,(H,25,29)
InChIKey ONHWSZIYZWNOFV-UHFFFAOYSA-N
Molecular Weight 415.515 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_1246
Solvent DMSO-d6
Source Vendor ID: NMR/12269406