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(2E,5Z)-2-[(4-bromophenyl)imino]-3-butyl-5-(5-chloro-3-ethyl-1,3-benzothiazol-2(3H)-ylidene)-1,3-thiazolidin-4-one
SpectraBase Compound ID LpqmdESjC5B
InChI InChI=1S/C22H21BrClN3OS2/c1-3-5-12-27-20(28)19(30-22(27)25-16-9-6-14(23)7-10-16)21-26(4-2)17-13-15(24)8-11-18(17)29-21/h6-11,13H,3-5,12H2,1-2H3/b21-19-,25-22+
InChIKey RZBRFXSSUULPRM-SHSIKMABSA-N
Mol Weight 522.91 g/mol
Molecular Formula C22H21BrClN3OS2
Exact Mass 520.999795 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1jNmltdTtUJ
Name (2E,5Z)-2-[(4-bromophenyl)imino]-3-butyl-5-(5-chloro-3-ethyl-1,3-benzothiazol-2(3H)-ylidene)-1,3-thiazolidin-4-one
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/C22H21BrClN3OS2/c1-3-5-12-27-20(28)19(30-22(27)25-16-9-6-14(23)7-10-16)21-26(4-2)17-13-15(24)8-11-18(17)29-21/h6-11,13H,3-5,12H2,1-2H3/b21-19-,25-22+
InChIKey RZBRFXSSUULPRM-SHSIKMABSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_5875
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: 62412; UBI_ID: UBI-005877
Synonyms 2-[(4-bromophenyl)imino]-3-butyl-5-(5-chloro-3-ethyl-1,3-benzothiazol-2(3H)-ylidene)-1,3-thiazolidin-4-one
Temperature 313 °C