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(3Z)-1-benzyl-5-bromo-3-{3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}-1,3-dihydro-2H-indol-2-one
SpectraBase Compound ID B9xSawzVsAe
InChI InChI=1S/C28H23BrN2O4S2/c1-34-22-11-8-17(14-23(22)35-2)12-13-30-27(33)25(37-28(30)36)24-20-15-19(29)9-10-21(20)31(26(24)32)16-18-6-4-3-5-7-18/h3-11,14-15H,12-13,16H2,1-2H3/b25-24-
InChIKey KJDTXVQPKVEHKK-IZHYLOQSSA-N
Mol Weight 595.53 g/mol
Molecular Formula C28H23BrN2O4S2
Exact Mass 594.028263 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3mt3MyQkLnL
Name (3Z)-1-benzyl-5-bromo-3-{3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}-1,3-dihydro-2H-indol-2-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/C28H23BrN2O4S2/c1-34-22-11-8-17(14-23(22)35-2)12-13-30-27(33)25(37-28(30)36)24-20-15-19(29)9-10-21(20)31(26(24)32)16-18-6-4-3-5-7-18/h3-11,14-15H,12-13,16H2,1-2H3/b25-24-
InChIKey KJDTXVQPKVEHKK-IZHYLOQSSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_6371
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: 123260; Labnumber: EX00116895; VK_ID: VK-006374
Synonyms 1-benzyl-5-bromo-3-{3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene}-1,3-dihydro-2H-indol-2-one
Temperature 315 °C