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N-(tert-butyl)-2-{[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-1,3-benzothiazol-2-yl]sulfanyl}acetamide
SpectraBase Compound ID 6Oy27oqRAz4
InChI InChI=1S/C21H19N3O3S2/c1-21(2,3)23-17(25)11-28-20-22-15-9-8-12(10-16(15)29-20)24-18(26)13-6-4-5-7-14(13)19(24)27/h4-10H,11H2,1-3H3,(H,23,25)
InChIKey SIVJRGOXNPLPNH-UHFFFAOYSA-N
Mol Weight 425.52 g/mol
Molecular Formula C21H19N3O3S2
Exact Mass 425.086784 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GPER64293uR
Name N-(tert-butyl)-2-{[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-1,3-benzothiazol-2-yl]sulfanyl}acetamide
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/C21H19N3O3S2/c1-21(2,3)23-17(25)11-28-20-22-15-9-8-12(10-16(15)29-20)24-18(26)13-6-4-5-7-14(13)19(24)27/h4-10H,11H2,1-3H3,(H,23,25)
InChIKey SIVJRGOXNPLPNH-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7000_4767
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: ZI/8056421; Labnumber: LP-0603770; IOH_ID: IOH-004768
Temperature 303 °C