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N-(4-methylphenyl)-2-{[4-(4-methylphenyl)-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID K7U7QvYWSTg
InChI InChI=1S/C23H21N5OS/c1-16-3-7-19(8-4-16)25-21(29)15-30-23-27-26-22(18-11-13-24-14-12-18)28(23)20-9-5-17(2)6-10-20/h3-14H,15H2,1-2H3,(H,25,29)
InChIKey OSJGKVJSYMORHY-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 KCWSaPifDci
Name N-(4-methylphenyl)-2-{[4-(4-methylphenyl)-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
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/C23H21N5OS/c1-16-3-7-19(8-4-16)25-21(29)15-30-23-27-26-22(18-11-13-24-14-12-18)28(23)20-9-5-17(2)6-10-20/h3-14H,15H2,1-2H3,(H,25,29)
InChIKey OSJGKVJSYMORHY-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_25628
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: D00819; Labnumber: UGRES-16487; SBI_ID: SBI-025632
Temperature 306 °C