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

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2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(3-ethoxy-4-hydroxyphenyl)methylidene]acetohydrazide
SpectraBase Compound ID 9mQqt04uDKO
InChI InChI=1S/C30H33N5O4S/c1-6-39-26-17-20(7-16-25(26)36)18-31-32-27(37)19-40-29-34-33-28(21-8-10-22(11-9-21)30(2,3)4)35(29)23-12-14-24(38-5)15-13-23/h7-18,36H,6,19H2,1-5H3,(H,32,37)/b31-18+
InChIKey FATXGKNATUSLHQ-FDAWAROLSA-N
Mol Weight 559.7 g/mol
Molecular Formula C30H33N5O4S
Exact Mass 559.225326 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3h7TqwMaaW1
Name 2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(3-ethoxy-4-hydroxyphenyl)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/C30H33N5O4S/c1-6-39-26-17-20(7-16-25(26)36)18-31-32-27(37)19-40-29-34-33-28(21-8-10-22(11-9-21)30(2,3)4)35(29)23-12-14-24(38-5)15-13-23/h7-18,36H,6,19H2,1-5H3,(H,32,37)/b31-18+
InChIKey FATXGKNATUSLHQ-FDAWAROLSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_6686
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: D23947; Labnumber: GRES-01671; SBI_ID: SBI-006689
Synonyms 2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(3-ethoxy-4-hydroxyphenyl)methylidene]acetohydrazide
Temperature 318 °C