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(5E)-1-(4-methylphenyl)-5-{1-[(3-pyridinylmethyl)amino]ethylidene}-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID 8jjRWkQSjgL
InChI InChI=1S/C19H18N4O3/c1-12-5-7-15(8-6-12)23-18(25)16(17(24)22-19(23)26)13(2)21-11-14-4-3-9-20-10-14/h3-10,21H,11H2,1-2H3,(H,22,24,26)/b16-13+
InChIKey RKXCVQDBGBJXPX-DTQAZKPQSA-N
Mol Weight 350.38 g/mol
Molecular Formula C19H18N4O3
Exact Mass 350.13789 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1zNHRxl1iPJ
Name (5E)-1-(4-Methylphenyl)-5-{1-[(3-pyridinylmethyl)amino]ethylidene}-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 350.137890453 u
Formula C19H18N4O3
InChI InChI=1S/C19H18N4O3/c1-12-5-7-15(8-6-12)23-18(25)16(17(24)22-19(23)26)13(2)21-11-14-4-3-9-20-10-14/h3-10,21H,11H2,1-2H3,(H,22,24,26)/b16-13+
InChIKey RKXCVQDBGBJXPX-DTQAZKPQSA-N
Molecular Weight 350.378 g/mol
SMILES N(\C(=C\1C(N(C(NC1=O)=O)C1=CC=C(C=C1)C)=O)C)CC=1C=NC=CC1