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3-thiophenecarboxylic acid, 4-(4-methoxyphenyl)-2-[[([1,2,4]triazolo[3,4-b]benzothiazol-3-ylthio)acetyl]amino]-, ethyl ester
SpectraBase Compound ID 1dJcGYpWzpv
InChI InChI=1S/C24H20N4O4S3/c1-3-32-22(30)20-16(14-8-10-15(31-2)11-9-14)12-33-21(20)25-19(29)13-34-23-26-27-24-28(23)17-6-4-5-7-18(17)35-24/h4-12H,3,13H2,1-2H3,(H,25,29)
InChIKey LFRSIUIVUXILJD-UHFFFAOYSA-N
Mol Weight 524.63 g/mol
Molecular Formula C24H20N4O4S3
Exact Mass 524.064669 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 31UoMCAq5Rw
Name 3-thiophenecarboxylic acid, 4-(4-methoxyphenyl)-2-[[([1,2,4]triazolo[3,4-b]benzothiazol-3-ylthio)acetyl]amino]-, ethyl ester
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/C24H20N4O4S3/c1-3-32-22(30)20-16(14-8-10-15(31-2)11-9-14)12-33-21(20)25-19(29)13-34-23-26-27-24-28(23)17-6-4-5-7-18(17)35-24/h4-12H,3,13H2,1-2H3,(H,25,29)
InChIKey LFRSIUIVUXILJD-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_932
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: NMR/11228639