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N-[5-(2-{(2E)-2-[3-methoxy-4-(1-phenylethoxy)benzylidene]hydrazino}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]-2-methylbenzamide
SpectraBase Compound ID JJkhxVJb716
InChI InChI=1S/C28H27N5O4S/c1-18-9-7-8-12-22(18)27(35)30-28-33-32-26(38-28)16-25(34)31-29-17-20-13-14-23(24(15-20)36-3)37-19(2)21-10-5-4-6-11-21/h4-15,17,19H,16H2,1-3H3,(H,31,34)(H,30,33,35)/b29-17+
InChIKey FOPTUCJWNBOZPN-STBIYBPSSA-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 E08CsCzPryb
Name N-[5-(2-{(2E)-2-[3-methoxy-4-(1-phenylethoxy)benzylidene]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/C28H27N5O4S/c1-18-9-7-8-12-22(18)27(35)30-28-33-32-26(38-28)16-25(34)31-29-17-20-13-14-23(24(15-20)36-3)37-19(2)21-10-5-4-6-11-21/h4-15,17,19H,16H2,1-3H3,(H,31,34)(H,30,33,35)/b29-17+
InChIKey FOPTUCJWNBOZPN-STBIYBPSSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_7527
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: 127333; Labnumber: CEP2K-04029; VK_ID: VK-007531
Synonyms N-[5-(2-{2-[3-methoxy-4-(1-phenylethoxy)benzylidene]hydrazino}-2-oxoethyl)-1,3,4-thiadiazol-2-yl]-2-methylbenzamide
Temperature 315 °C