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N-[1,1'-biphenyl]-2-yl-2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
SpectraBase Compound ID EiM9YomvvTJ
InChI InChI=1S/C33H32N4O2S/c1-33(2,3)25-16-14-24(15-17-25)31-35-36-32(37(31)26-18-20-27(39-4)21-19-26)40-22-30(38)34-29-13-9-8-12-28(29)23-10-6-5-7-11-23/h5-21H,22H2,1-4H3,(H,34,38)
InChIKey WCFHGKZLEOMUIY-UHFFFAOYSA-N
Mol Weight 548.7 g/mol
Molecular Formula C33H32N4O2S
Exact Mass 548.224597 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FtKhAAjWlTE
Name N-[1,1'-biphenyl]-2-yl-2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C33H32N4O2S/c1-33(2,3)25-16-14-24(15-17-25)31-35-36-32(37(31)26-18-20-27(39-4)21-19-26)40-22-30(38)34-29-13-9-8-12-28(29)23-10-6-5-7-11-23/h5-21H,22H2,1-4H3,(H,34,38)
InChIKey WCFHGKZLEOMUIY-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_4961
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: E08427; Labnumber: GRES-37049; SBI_ID: SBI-004963
Temperature 308 °C