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ethyl 4-{4-[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}-1-piperazinecarboxylate
SpectraBase Compound ID B84njk4VEvV
InChI InChI=1S/C21H24ClN3O4S2/c1-2-29-20(28)24-12-10-23(11-13-24)18(26)8-5-9-25-19(27)17(31-21(25)30)14-15-6-3-4-7-16(15)22/h3-4,6-7,14H,2,5,8-13H2,1H3/b17-14-
InChIKey FOUGYKYLEBSCJK-VKAVYKQESA-N
Mol Weight 482.01 g/mol
Molecular Formula C21H24ClN3O4S2
Exact Mass 481.089676 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5A8Xn6caPoc
Name ethyl 4-{4-[(5Z)-5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}-1-piperazinecarboxylate
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/C21H24ClN3O4S2/c1-2-29-20(28)24-12-10-23(11-13-24)18(26)8-5-9-25-19(27)17(31-21(25)30)14-15-6-3-4-7-16(15)22/h3-4,6-7,14H,2,5,8-13H2,1H3/b17-14-
InChIKey FOUGYKYLEBSCJK-VKAVYKQESA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_9743
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: 128454; Labnumber: EX00110806; VK_ID: VK-009747
Synonyms ethyl 4-{4-[5-(2-chlorobenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}-1-piperazinecarboxylate
Temperature 318 °C