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N-(3-chloro-2-methylphenyl)-2-[(4-(3-methylphenyl)-5-{[(4-methylphenyl)sulfanyl]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide

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N-(3-chloro-2-methylphenyl)-2-[(4-(3-methylphenyl)-5-{[(4-methylphenyl)sulfanyl]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
SpectraBase Compound ID 5xhwJ7bOxMD
InChI InChI=1S/C26H25ClN4OS2/c1-17-10-12-21(13-11-17)33-15-24-29-30-26(31(24)20-7-4-6-18(2)14-20)34-16-25(32)28-23-9-5-8-22(27)19(23)3/h4-14H,15-16H2,1-3H3,(H,28,32)
InChIKey ZFXNOIYDIAAQEZ-UHFFFAOYSA-N
Mol Weight 509.09 g/mol
Molecular Formula C26H25ClN4OS2
Exact Mass 508.115831 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KuljZrhfugV
Name N-(3-chloro-2-methylphenyl)-2-[(4-(3-methylphenyl)-5-{[(4-methylphenyl)sulfanyl]methyl}-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/C26H25ClN4OS2/c1-17-10-12-21(13-11-17)33-15-24-29-30-26(31(24)20-7-4-6-18(2)14-20)34-16-25(32)28-23-9-5-8-22(27)19(23)3/h4-14H,15-16H2,1-3H3,(H,28,32)
InChIKey ZFXNOIYDIAAQEZ-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_6679
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/11261899; Labnumber: 1476; IOH_ID: IOH-006680