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2-{[5-(2,4-dichlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,5-dimethylphenyl)acetamide
SpectraBase Compound ID DsPFo27sNEg
InChI InChI=1S/C25H22Cl2N4OS/c1-15-5-9-19(10-6-15)31-24(20-11-8-18(26)13-21(20)27)29-30-25(31)33-14-23(32)28-22-12-16(2)4-7-17(22)3/h4-13H,14H2,1-3H3,(H,28,32)
InChIKey DTIAGIZSWGXWOJ-UHFFFAOYSA-N
Mol Weight 497.44 g/mol
Molecular Formula C25H22Cl2N4OS
Exact Mass 496.089138 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3P4fAo3CqHV
Name 2-{[5-(2,4-dichlorophenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,5-dimethylphenyl)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/C25H22Cl2N4OS/c1-15-5-9-19(10-6-15)31-24(20-11-8-18(26)13-21(20)27)29-30-25(31)33-14-23(32)28-22-12-16(2)4-7-17(22)3/h4-13H,14H2,1-3H3,(H,28,32)
InChIKey DTIAGIZSWGXWOJ-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_5530
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/11221739; Labnumber: 0701; IOH_ID: IOH-005531