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

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N-(4-bromo-2-methylphenyl)-2-{[4-(4-ethoxyphenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID 8CLClwQJeqw
InChI InChI=1S/C26H25BrN4O3S/c1-4-34-22-12-8-20(9-13-22)31-25(18-5-10-21(33-3)11-6-18)29-30-26(31)35-16-24(32)28-23-14-7-19(27)15-17(23)2/h5-15H,4,16H2,1-3H3,(H,28,32)
InChIKey GNDMKOCMVZLSSH-UHFFFAOYSA-N
Mol Weight 553.48 g/mol
Molecular Formula C26H25BrN4O3S
Exact Mass 552.083075 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2IcXDmYoGWn
Name N-(4-bromo-2-methylphenyl)-2-{[4-(4-ethoxyphenyl)-5-(4-methoxyphenyl)-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/C26H25BrN4O3S/c1-4-34-22-12-8-20(9-13-22)31-25(18-5-10-21(33-3)11-6-18)29-30-26(31)35-16-24(32)28-23-14-7-19(27)15-17(23)2/h5-15H,4,16H2,1-3H3,(H,28,32)
InChIKey GNDMKOCMVZLSSH-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14338
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: D98219; Labnumber: GRES-17553; SBI_ID: SBI-014341
Temperature 308 °C