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(5E)-5-({[2-(dimethylamino)ethyl]amino}methylene)-1-(4-fluorobenzyl)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
SpectraBase Compound ID AhrgCDK5Jp8
InChI InChI=1S/C16H19FN4O2S/c1-20(2)8-7-18-9-13-14(22)19-16(24)21(15(13)23)10-11-3-5-12(17)6-4-11/h3-6,9,18H,7-8,10H2,1-2H3,(H,19,22,24)/b13-9+
InChIKey MUOJOBMIRTXASH-UKTHLTGXSA-N
Mol Weight 350.41 g/mol
Molecular Formula C16H19FN4O2S
Exact Mass 350.121275 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6pcWTqBomtj
Name (5E)-5-({[2-(dimethylamino)ethyl]amino}methylene)-1-(4-fluorobenzyl)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
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/C16H19FN4O2S/c1-20(2)8-7-18-9-13-14(22)19-16(24)21(15(13)23)10-11-3-5-12(17)6-4-11/h3-6,9,18H,7-8,10H2,1-2H3,(H,19,22,24)/b13-9+
InChIKey MUOJOBMIRTXASH-UKTHLTGXSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_17605
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: D28756; Labnumber: KKA-0211-2498; SBI_ID: SBI-017608
Synonyms 5-({[2-(dimethylamino)ethyl]amino}methylene)-1-(4-fluorobenzyl)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Temperature 318 °C