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2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(4-propoxyphenyl)methylidene]acetohydrazide

View entire compound with spectra: 1 NMR

2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(4-propoxyphenyl)methylidene]acetohydrazide
SpectraBase Compound ID 1kDakEqR7Dw
InChI InChI=1S/C31H35N5O3S/c1-6-19-39-27-15-7-22(8-16-27)20-32-33-28(37)21-40-30-35-34-29(23-9-11-24(12-10-23)31(2,3)4)36(30)25-13-17-26(38-5)18-14-25/h7-18,20H,6,19,21H2,1-5H3,(H,33,37)/b32-20+
InChIKey SOYPUBJYQMAEJU-UZWMFBFFSA-N
Mol Weight 557.7 g/mol
Molecular Formula C31H35N5O3S
Exact Mass 557.246061 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4N1YAc3P3TI
Name 2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(4-propoxyphenyl)methylidene]acetohydrazide
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/C31H35N5O3S/c1-6-19-39-27-15-7-22(8-16-27)20-32-33-28(37)21-40-30-35-34-29(23-9-11-24(12-10-23)31(2,3)4)36(30)25-13-17-26(38-5)18-14-25/h7-18,20H,6,19,21H2,1-5H3,(H,33,37)/b32-20+
InChIKey SOYPUBJYQMAEJU-UZWMFBFFSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_6690
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: D23967; Labnumber: GRES-01691; SBI_ID: SBI-006693
Synonyms 2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(4-propoxyphenyl)methylidene]acetohydrazide
Temperature 318 °C