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3-thiazolidinebutanamide, 5-[(3-fluorophenyl)methylene]-N-[3-(1H-imidazol-1-yl)propyl]-4-oxo-2-thioxo-, (5E)-
SpectraBase Compound ID FXdHZvVXfU8
InChI InChI=1S/C20H21FN4O2S2/c21-16-5-1-4-15(12-16)13-17-19(27)25(20(28)29-17)10-2-6-18(26)23-7-3-9-24-11-8-22-14-24/h1,4-5,8,11-14H,2-3,6-7,9-10H2,(H,23,26)/b17-13+
InChIKey DQMFDZCJCCYJNO-GHRIWEEISA-N
Mol Weight 432.53 g/mol
Molecular Formula C20H21FN4O2S2
Exact Mass 432.108996 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 97M3j6FMzfY
Name 3-thiazolidinebutanamide, 5-[(3-fluorophenyl)methylene]-N-[3-(1H-imidazol-1-yl)propyl]-4-oxo-2-thioxo-, (5E)-
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/C20H21FN4O2S2/c21-16-5-1-4-15(12-16)13-17-19(27)25(20(28)29-17)10-2-6-18(26)23-7-3-9-24-11-8-22-14-24/h1,4-5,8,11-14H,2-3,6-7,9-10H2,(H,23,26)/b17-13+
InChIKey DQMFDZCJCCYJNO-GHRIWEEISA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_1603
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: F11992; Labnumber: EXGOR1-11462