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(2E,5Z)-3-butyl-5-(5-chloro-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-2-[(3,5-dimethyl-1H-pyrazol-4-yl)imino]-1,3-thiazolidin-4-one

View entire compound with spectra: 1 NMR

(2E,5Z)-3-butyl-5-(5-chloro-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-2-[(3,5-dimethyl-1H-pyrazol-4-yl)imino]-1,3-thiazolidin-4-one
SpectraBase Compound ID 7RvNeIOooMu
InChI InChI=1S/C20H22ClN5OS2/c1-5-6-9-26-18(27)17(29-20(26)22-16-11(2)23-24-12(16)3)19-25(4)14-10-13(21)7-8-15(14)28-19/h7-8,10H,5-6,9H2,1-4H3,(H,23,24)/b19-17-,22-20+
InChIKey JACGFSGWKKACCZ-PNFLQUQDSA-N
Mol Weight 448.0 g/mol
Molecular Formula C20H22ClN5OS2
Exact Mass 447.09543 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1BYV6unFHs2
Name (2E,5Z)-3-butyl-5-(5-chloro-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-2-[(3,5-dimethyl-1H-pyrazol-4-yl)imino]-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/C20H22ClN5OS2/c1-5-6-9-26-18(27)17(29-20(26)22-16-11(2)23-24-12(16)3)19-25(4)14-10-13(21)7-8-15(14)28-19/h7-8,10H,5-6,9H2,1-4H3,(H,23,24)/b19-17-,22-20+
InChIKey JACGFSGWKKACCZ-PNFLQUQDSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_5876
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: 62413; UBI_ID: UBI-005878
Synonyms 3-butyl-5-(5-chloro-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-2-[(3,5-dimethyl-1H-pyrazol-4-yl)imino]-1,3-thiazolidin-4-one
Temperature 313 °C