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2-{[4-phenyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-{(E)-[4-(trifluoromethyl)phenyl]methylidene}acetohydrazide
SpectraBase Compound ID 5Kx33XsTKr
InChI InChI=1S/C27H24F3N5O4S/c1-37-21-13-18(14-22(38-2)24(21)39-3)25-33-34-26(35(25)20-7-5-4-6-8-20)40-16-23(36)32-31-15-17-9-11-19(12-10-17)27(28,29)30/h4-15H,16H2,1-3H3,(H,32,36)/b31-15+
InChIKey GHCOPTYLWULEBL-IBBHUPRXSA-N
Mol Weight 571.58 g/mol
Molecular Formula C27H24F3N5O4S
Exact Mass 571.15011 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8gkR8NvudC8
Name 2-{[4-phenyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-{(E)-[4-(trifluoromethyl)phenyl]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/C27H24F3N5O4S/c1-37-21-13-18(14-22(38-2)24(21)39-3)25-33-34-26(35(25)20-7-5-4-6-8-20)40-16-23(36)32-31-15-17-9-11-19(12-10-17)27(28,29)30/h4-15H,16H2,1-3H3,(H,32,36)/b31-15+
InChIKey GHCOPTYLWULEBL-IBBHUPRXSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_16391
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: D23637; Labnumber: GRES-01251; SBI_ID: SBI-016394
Synonyms 2-{[4-phenyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-{[4-(trifluoromethyl)phenyl]methylidene}acetohydrazide
Temperature 315 °C