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2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-1-(3,4-dichlorophenyl)ethylidene]acetohydrazide
SpectraBase Compound ID uRYTkarXKx
InChI InChI=1S/C25H20Cl3N5O2S/c1-15(17-5-12-21(27)22(28)13-17)29-30-23(34)14-36-25-32-31-24(16-3-10-20(35-2)11-4-16)33(25)19-8-6-18(26)7-9-19/h3-13H,14H2,1-2H3,(H,30,34)/b29-15+
InChIKey DXOLVLZMSNBYPQ-WKULSOCRSA-N
Mol Weight 560.89 g/mol
Molecular Formula C25H20Cl3N5O2S
Exact Mass 559.040329 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Lf5VPp0U61s
Name 2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-1-(3,4-dichlorophenyl)ethylidene]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/C25H20Cl3N5O2S/c1-15(17-5-12-21(27)22(28)13-17)29-30-23(34)14-36-25-32-31-24(16-3-10-20(35-2)11-4-16)33(25)19-8-6-18(26)7-9-19/h3-13H,14H2,1-2H3,(H,30,34)/b29-15+
InChIKey DXOLVLZMSNBYPQ-WKULSOCRSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_16639
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: D23791; Labnumber: GRES-01513; SBI_ID: SBI-016642
Synonyms 2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[1-(3,4-dichlorophenyl)ethylidene]acetohydrazide
Temperature 315 °C