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2-{[4-allyl-5-(4-tert-butylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide

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2-{[4-allyl-5-(4-tert-butylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide
SpectraBase Compound ID 9NcKdZHVA45
InChI InChI=1S/C24H28N4O2S/c1-6-15-28-22(17-7-9-18(10-8-17)24(2,3)4)26-27-23(28)31-16-21(29)25-19-11-13-20(30-5)14-12-19/h6-14H,1,15-16H2,2-5H3,(H,25,29)
InChIKey YVZPNBNVFLPMLM-UHFFFAOYSA-N
Mol Weight 436.57 g/mol
Molecular Formula C24H28N4O2S
Exact Mass 436.193297 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BgkqIIU2vdt
Name 2-{[4-allyl-5-(4-tert-butylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methoxyphenyl)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/C24H28N4O2S/c1-6-15-28-22(17-7-9-18(10-8-17)24(2,3)4)26-27-23(28)31-16-21(29)25-19-11-13-20(30-5)14-12-19/h6-14H,1,15-16H2,2-5H3,(H,25,29)
InChIKey YVZPNBNVFLPMLM-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_14326
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: D98202; Labnumber: GRES-17273; SBI_ID: SBI-014329
Temperature 308 °C