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(5E)-1-[2-(1-cyclohexen-1-yl)ethyl]-5-({[3-(4-morpholinyl)propyl]amino}methylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione

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(5E)-1-[2-(1-cyclohexen-1-yl)ethyl]-5-({[3-(4-morpholinyl)propyl]amino}methylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
SpectraBase Compound ID 2pLdh48l6uw
InChI InChI=1S/C20H30N4O3S/c25-18-17(15-21-8-4-9-23-11-13-27-14-12-23)19(26)24(20(28)22-18)10-7-16-5-2-1-3-6-16/h5,15,21H,1-4,6-14H2,(H,22,25,28)/b17-15+
InChIKey CYJJBKDBLQVCGJ-BMRADRMJSA-N
Mol Weight 406.55 g/mol
Molecular Formula C20H30N4O3S
Exact Mass 406.203862 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2lJS3jsxiy2
Name (5E)-1-[2-(1-cyclohexen-1-yl)ethyl]-5-({[3-(4-morpholinyl)propyl]amino}methylene)-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/C20H30N4O3S/c25-18-17(15-21-8-4-9-23-11-13-27-14-12-23)19(26)24(20(28)22-18)10-7-16-5-2-1-3-6-16/h5,15,21H,1-4,6-14H2,(H,22,25,28)/b17-15+
InChIKey CYJJBKDBLQVCGJ-BMRADRMJSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_17610
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: D28773; Labnumber: KKA-0211-2586; SBI_ID: SBI-017613
Synonyms 1-[2-(1-cyclohexen-1-yl)ethyl]-5-({[3-(4-morpholinyl)propyl]amino}methylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
Temperature 318 °C