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(5Z)-5-({1-[3-(4-chlorophenoxy)propyl]-1H-pyrrol-2-yl}methylene)-1-(2-furylmethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID 7IsjpnVHGkt
InChI InChI=1S/C23H20ClN3O5/c24-16-6-8-18(9-7-16)31-13-3-11-26-10-1-4-17(26)14-20-21(28)25-23(30)27(22(20)29)15-19-5-2-12-32-19/h1-2,4-10,12,14H,3,11,13,15H2,(H,25,28,30)/b20-14-
InChIKey SEJNPJASPYAPJB-ZHZULCJRSA-N
Mol Weight 453.88 g/mol
Molecular Formula C23H20ClN3O5
Exact Mass 453.109148 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FErCJFSLwvu
Name (5Z)-5-({1-[3-(4-chlorophenoxy)propyl]-1H-pyrrol-2-yl}methylene)-1-(2-furylmethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C23H20ClN3O5/c24-16-6-8-18(9-7-16)31-13-3-11-26-10-1-4-17(26)14-20-21(28)25-23(30)27(22(20)29)15-19-5-2-12-32-19/h1-2,4-10,12,14H,3,11,13,15H2,(H,25,28,30)/b20-14-
InChIKey SEJNPJASPYAPJB-ZHZULCJRSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_19824
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: D14630; Labnumber: CEP2K-32513; SBI_ID: SBI-019828
Synonyms 5-({1-[3-(4-chlorophenoxy)propyl]-1H-pyrrol-2-yl}methylene)-1-(2-furylmethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
Temperature 318 °C