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2-[3-((E)-{(2Z)-3-cyclohexyl-2-[(4-fluorophenyl)imino]-4-oxo-1,3-thiazolidin-5-ylidene}methyl)-2,5-dimethyl-1H-pyrrol-1-yl]-4,5-dimethyl-3-thiophenecarbonitrile

View entire compound with spectra: 1 NMR

2-[3-((E)-{(2Z)-3-cyclohexyl-2-[(4-fluorophenyl)imino]-4-oxo-1,3-thiazolidin-5-ylidene}methyl)-2,5-dimethyl-1H-pyrrol-1-yl]-4,5-dimethyl-3-thiophenecarbonitrile
SpectraBase Compound ID GriK3K4aZBz
InChI InChI=1S/C29H29FN4OS2/c1-17-14-21(19(3)33(17)28-25(16-31)18(2)20(4)36-28)15-26-27(35)34(24-8-6-5-7-9-24)29(37-26)32-23-12-10-22(30)11-13-23/h10-15,24H,5-9H2,1-4H3/b26-15+,32-29-
InChIKey HFNQWOQFFVXKEO-RJPJOXNKSA-N
Mol Weight 532.7 g/mol
Molecular Formula C29H29FN4OS2
Exact Mass 532.176682 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LZXoCzBWqM7
Name 2-[3-((E)-{(2Z)-3-cyclohexyl-2-[(4-fluorophenyl)imino]-4-oxo-1,3-thiazolidin-5-ylidene}methyl)-2,5-dimethyl-1H-pyrrol-1-yl]-4,5-dimethyl-3-thiophenecarbonitrile
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/C29H29FN4OS2/c1-17-14-21(19(3)33(17)28-25(16-31)18(2)20(4)36-28)15-26-27(35)34(24-8-6-5-7-9-24)29(37-26)32-23-12-10-22(30)11-13-23/h10-15,24H,5-9H2,1-4H3/b26-15+,32-29-
InChIKey HFNQWOQFFVXKEO-RJPJOXNKSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_2781
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: 9312372; UBI_ID: UBI-002782
Synonyms 2-[3-({3-cyclohexyl-2-[(4-fluorophenyl)imino]-4-oxo-1,3-thiazolidin-5-ylidene}methyl)-2,5-dimethyl-1H-pyrrol-1-yl]-4,5-dimethyl-3-thiophenecarbonitrile
Temperature 313 °C