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(5Z)-5-[(3-chloroanilino)methylene]-1-(4-methylphenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID FdehnAecGSB
InChI InChI=1S/C18H14ClN3O3/c1-11-5-7-14(8-6-11)22-17(24)15(16(23)21-18(22)25)10-20-13-4-2-3-12(19)9-13/h2-10,20H,1H3,(H,21,23,25)/b15-10-
InChIKey SSDBTQDLSVAXNJ-GDNBJRDFSA-N
Mol Weight 355.78 g/mol
Molecular Formula C18H14ClN3O3
Exact Mass 355.072369 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FYmFb0wuWTJ
Name (5Z)-5-[(3-Chloroanilino)methylene]-1-(4-methylphenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 355.072369020 u
Formula C18H14ClN3O3
InChI InChI=1S/C18H14ClN3O3/c1-11-5-7-14(8-6-11)22-17(24)15(16(23)21-18(22)25)10-20-13-4-2-3-12(19)9-13/h2-10,20H,1H3,(H,21,23,25)/b15-10-
InChIKey SSDBTQDLSVAXNJ-GDNBJRDFSA-N
Molecular Weight 355.781 g/mol
SMILES N1C(\C(=C\NC2=CC(Cl)=CC=C2)C(N(C1=O)C1=CC=C(C=C1)C)=O)=O