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3-{[(2Z,5Z)-3-butyl-5-(5-chloro-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-4-oxo-1,3-thiazolidin-2-ylidene]amino}-4-(ethylamino)benzonitrile
SpectraBase Compound ID IcPR0W8LoIR
InChI InChI=1S/C24H24ClN5OS2/c1-4-6-11-30-22(31)21(23-29(3)19-13-16(25)8-10-20(19)32-23)33-24(30)28-18-12-15(14-26)7-9-17(18)27-5-2/h7-10,12-13,27H,4-6,11H2,1-3H3/b23-21-,28-24-
InChIKey QYOFHDNQJIXOFY-MSZRYLLASA-N
Mol Weight 498.06 g/mol
Molecular Formula C24H24ClN5OS2
Exact Mass 497.11108 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID B9UhFY1VKIU
Name 3-{[(2Z,5Z)-3-butyl-5-(5-chloro-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-4-oxo-1,3-thiazolidin-2-ylidene]amino}-4-(ethylamino)benzonitrile
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/C24H24ClN5OS2/c1-4-6-11-30-22(31)21(23-29(3)19-13-16(25)8-10-20(19)32-23)33-24(30)28-18-12-15(14-26)7-9-17(18)27-5-2/h7-10,12-13,27H,4-6,11H2,1-3H3/b23-21-,28-24-
InChIKey QYOFHDNQJIXOFY-MSZRYLLASA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_5894
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: 62444; UBI_ID: UBI-005896
Synonyms 3-{[3-butyl-5-(5-chloro-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-4-oxo-1,3-thiazolidin-2-ylidene]amino}-4-(ethylamino)benzonitrile
Temperature 313 °C