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N-[5-(2-{(2E)-2-[4-(benzyloxy)-3-chloro-5-ethoxybenzylidene]hydrazino}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]-2-methylbenzamide
SpectraBase Compound ID J7xLKkHDDay
InChI InChI=1S/C28H26ClN5O4S/c1-3-37-23-14-20(13-22(29)26(23)38-17-19-10-5-4-6-11-19)16-30-32-24(35)15-25-33-34-28(39-25)31-27(36)21-12-8-7-9-18(21)2/h4-14,16H,3,15,17H2,1-2H3,(H,32,35)(H,31,34,36)/b30-16+
InChIKey NASRJYSLLFCAIP-OKCVXOCRSA-N
Mol Weight 564.06 g/mol
Molecular Formula C28H26ClN5O4S
Exact Mass 563.139403 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID D7Zg3ZRl3F9
Name N-[5-(2-{(2E)-2-[4-(benzyloxy)-3-chloro-5-ethoxybenzylidene]hydrazino}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]-2-methylbenzamide
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/C28H26ClN5O4S/c1-3-37-23-14-20(13-22(29)26(23)38-17-19-10-5-4-6-11-19)16-30-32-24(35)15-25-33-34-28(39-25)31-27(36)21-12-8-7-9-18(21)2/h4-14,16H,3,15,17H2,1-2H3,(H,32,35)(H,31,34,36)/b30-16+
InChIKey NASRJYSLLFCAIP-OKCVXOCRSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_7541
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: 127352; Labnumber: CEP2K-04100; VK_ID: VK-007545
Synonyms N-[5-(2-{2-[4-(benzyloxy)-3-chloro-5-ethoxybenzylidene]hydrazino}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]-2-methylbenzamide
Temperature 315 °C