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

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2-{[5-(4-bromophenyl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dimethylphenyl)acetamide
SpectraBase Compound ID 3PeUTv9I2YZ
InChI InChI=1S/C25H23BrN4OS/c1-16-5-4-6-21(14-16)30-24(19-8-10-20(26)11-9-19)28-29-25(30)32-15-23(31)27-22-12-7-17(2)13-18(22)3/h4-14H,15H2,1-3H3,(H,27,31)
InChIKey XSRZJKRPAISFGD-UHFFFAOYSA-N
Mol Weight 507.45 g/mol
Molecular Formula C25H23BrN4OS
Exact Mass 506.077596 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3RnnW8EtODY
Name 2-{[5-(4-bromophenyl)-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-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/C25H23BrN4OS/c1-16-5-4-6-21(14-16)30-24(19-8-10-20(26)11-9-19)28-29-25(30)32-15-23(31)27-22-12-7-17(2)13-18(22)3/h4-14H,15H2,1-3H3,(H,27,31)
InChIKey XSRZJKRPAISFGD-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_6646
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/11261864; Labnumber: 1440; IOH_ID: IOH-006647