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(2E,5Z)-2-[(3-acetylphenyl)imino]-3-butyl-5-(5-chloro-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-1,3-thiazolidin-4-one
SpectraBase Compound ID 4yF8E9ChNfl
InChI InChI=1S/C23H22ClN3O2S2/c1-4-5-11-27-21(29)20(22-26(3)18-13-16(24)9-10-19(18)30-22)31-23(27)25-17-8-6-7-15(12-17)14(2)28/h6-10,12-13H,4-5,11H2,1-3H3/b22-20-,25-23+
InChIKey FMTKSSLAIUBSSR-CCSRSWJSSA-N
Mol Weight 472.02 g/mol
Molecular Formula C23H22ClN3O2S2
Exact Mass 471.084197 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6IzPdkon8Zi
Name (2E,5Z)-2-[(3-acetylphenyl)imino]-3-butyl-5-(5-chloro-3-methyl-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/C23H22ClN3O2S2/c1-4-5-11-27-21(29)20(22-26(3)18-13-16(24)9-10-19(18)30-22)31-23(27)25-17-8-6-7-15(12-17)14(2)28/h6-10,12-13H,4-5,11H2,1-3H3/b22-20-,25-23+
InChIKey FMTKSSLAIUBSSR-CCSRSWJSSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_5891
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: 62438; UBI_ID: UBI-005893
Synonyms 2-[(3-acetylphenyl)imino]-3-butyl-5-(5-chloro-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-1,3-thiazolidin-4-one
Temperature 313 °C