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2-{[4-(4-methoxyphenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(3-nitrophenyl)methylidene]acetohydrazide
SpectraBase Compound ID LBIESlpNxID
InChI InChI=1S/C25H22N6O4S/c1-17-6-8-19(9-7-17)24-28-29-25(30(24)20-10-12-22(35-2)13-11-20)36-16-23(32)27-26-15-18-4-3-5-21(14-18)31(33)34/h3-15H,16H2,1-2H3,(H,27,32)/b26-15+
InChIKey HDIJQMFGPIDWEL-CVKSISIWSA-N
Mol Weight 502.55 g/mol
Molecular Formula C25H22N6O4S
Exact Mass 502.142324 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7lAzQxkZeOW
Name 2-{[4-(4-methoxyphenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(3-nitrophenyl)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/C25H22N6O4S/c1-17-6-8-19(9-7-17)24-28-29-25(30(24)20-10-12-22(35-2)13-11-20)36-16-23(32)27-26-15-18-4-3-5-21(14-18)31(33)34/h3-15H,16H2,1-2H3,(H,27,32)/b26-15+
InChIKey HDIJQMFGPIDWEL-CVKSISIWSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_15303
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: C24708; Labnumber: UGRES-07337; SBI_ID: SBI-015306
Synonyms 2-{[4-(4-methoxyphenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(3-nitrophenyl)methylidene]acetohydrazide
Temperature 318 °C