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2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-1-(3,4-dimethoxyphenyl)ethylidene]acetohydrazide

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2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-1-(3,4-dimethoxyphenyl)ethylidene]acetohydrazide
SpectraBase Compound ID KL5K5PVdWi4
InChI InChI=1S/C27H26ClN5O4S/c1-17(19-7-14-23(36-3)24(15-19)37-4)29-30-25(34)16-38-27-32-31-26(18-5-12-22(35-2)13-6-18)33(27)21-10-8-20(28)9-11-21/h5-15H,16H2,1-4H3,(H,30,34)/b29-17+
InChIKey JYERYUCUUJRCGX-STBIYBPSSA-N
Mol Weight 552.05 g/mol
Molecular Formula C27H26ClN5O4S
Exact Mass 551.139403 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID F52Gvssyfwo
Name 2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-1-(3,4-dimethoxyphenyl)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/C27H26ClN5O4S/c1-17(19-7-14-23(36-3)24(15-19)37-4)29-30-25(34)16-38-27-32-31-26(18-5-12-22(35-2)13-6-18)33(27)21-10-8-20(28)9-11-21/h5-15H,16H2,1-4H3,(H,30,34)/b29-17+
InChIKey JYERYUCUUJRCGX-STBIYBPSSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_16638
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: D23789; Labnumber: GRES-01511; SBI_ID: SBI-016641
Synonyms 2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[1-(3,4-dimethoxyphenyl)ethylidene]acetohydrazide
Temperature 315 °C