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ethyl 4-{[(5Z)-5-(4-isopropylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetyl}-1-piperazinecarboxylate
SpectraBase Compound ID 3iRT1DV1ma9
InChI InChI=1S/C22H27N3O4S2/c1-4-29-21(28)24-11-9-23(10-12-24)19(26)14-25-20(27)18(31-22(25)30)13-16-5-7-17(8-6-16)15(2)3/h5-8,13,15H,4,9-12,14H2,1-3H3/b18-13-
InChIKey ULZIFTNNZZEBAH-AQTBWJFISA-N
Mol Weight 461.6 g/mol
Molecular Formula C22H27N3O4S2
Exact Mass 461.144299 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HbNltkcptj0
Name ethyl 4-{[(5Z)-5-(4-isopropylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetyl}-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/C22H27N3O4S2/c1-4-29-21(28)24-11-9-23(10-12-24)19(26)14-25-20(27)18(31-22(25)30)13-16-5-7-17(8-6-16)15(2)3/h5-8,13,15H,4,9-12,14H2,1-3H3/b18-13-
InChIKey ULZIFTNNZZEBAH-AQTBWJFISA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_10986
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: E04131; Labnumber: EX00108043; SBI_ID: SBI-010989
Synonyms ethyl 4-{[5-(4-isopropylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetyl}-1-piperazinecarboxylate
Temperature 308 °C