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2-bromo-N-(2-{[2-(5-chloro-2-methylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)benzamide
SpectraBase Compound ID LvZ3Xbtuc2y
InChI InChI=1S/C23H17BrClN3O2S2/c1-13-6-7-14(25)10-19(13)27-21(29)12-31-23-28-18-9-8-15(11-20(18)32-23)26-22(30)16-4-2-3-5-17(16)24/h2-11H,12H2,1H3,(H,26,30)(H,27,29)
InChIKey SJILGECKADHTAK-UHFFFAOYSA-N
Mol Weight 546.89 g/mol
Molecular Formula C23H17BrClN3O2S2
Exact Mass 544.96341 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G5Mlxa7Epsr
Name 2-bromo-N-(2-{[2-(5-chloro-2-methylanilino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-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/C23H17BrClN3O2S2/c1-13-6-7-14(25)10-19(13)27-21(29)12-31-23-28-18-9-8-15(11-20(18)32-23)26-22(30)16-4-2-3-5-17(16)24/h2-11H,12H2,1H3,(H,26,30)(H,27,29)
InChIKey SJILGECKADHTAK-UHFFFAOYSA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_3669
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/7058799; Labnumber: LP-0602068; IOH_ID: IOH-003670
Temperature 297 °C