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2-methyl-N-{5-[2-((2E)-2-{2-[2-(3-methylphenoxy)ethoxy]benzylidene}hydrazino)-2-oxoethyl]-1,3,4-thiadiazol-2-yl}benzamide
SpectraBase Compound ID 9In6Xv3E0UZ
InChI InChI=1S/C28H27N5O4S/c1-19-8-7-11-22(16-19)36-14-15-37-24-13-6-4-10-21(24)18-29-31-25(34)17-26-32-33-28(38-26)30-27(35)23-12-5-3-9-20(23)2/h3-13,16,18H,14-15,17H2,1-2H3,(H,31,34)(H,30,33,35)/b29-18+
InChIKey XSFMYDMEOZGBAL-RDRPBHBLSA-N
Mol Weight 529.62 g/mol
Molecular Formula C28H27N5O4S
Exact Mass 529.178376 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1PKuz3NKpMb
Name 2-methyl-N-{5-[2-((2E)-2-{2-[2-(3-methylphenoxy)ethoxy]benzylidene}hydrazino)-2-oxoethyl]-1,3,4-thiadiazol-2-yl}benzamide
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/C28H27N5O4S/c1-19-8-7-11-22(16-19)36-14-15-37-24-13-6-4-10-21(24)18-29-31-25(34)17-26-32-33-28(38-26)30-27(35)23-12-5-3-9-20(23)2/h3-13,16,18H,14-15,17H2,1-2H3,(H,31,34)(H,30,33,35)/b29-18+
InChIKey XSFMYDMEOZGBAL-RDRPBHBLSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_7525
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: 127331; Labnumber: CEP2K-04027; VK_ID: VK-007529
Synonyms 2-methyl-N-{5-[2-(2-{2-[2-(3-methylphenoxy)ethoxy]benzylidene}hydrazino)-2-oxoethyl]-1,3,4-thiadiazol-2-yl}benzamide
Temperature 315 °C