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4-(4-Methoxyphenyl)-2-[3(2H)-oxo-5-phenyl-2-pyrazolyl]-6-(p-tolyl)pyrimidine
SpectraBase Compound ID DyFLds4uv1s
InChI InChI=1S/C27H22N4O2/c1-18-8-10-20(11-9-18)23-16-24(21-12-14-22(33-2)15-13-21)29-27(28-23)31-26(32)17-25(30-31)19-6-4-3-5-7-19/h3-17,30H,1-2H3
InChIKey CGQBRVQGIJKMHA-UHFFFAOYSA-N
Mol Weight 434.5 g/mol
Molecular Formula C27H22N4O2
Exact Mass 434.174276 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CzeO9zoRJYr
Name 4-(4-Methoxyphenyl)-2-[3(2H)-oxo-5-phenyl-2-pyrazolyl]-6-(p-tolyl)pyrimidine
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H22N4O2
InChI InChI=1S/C27H22N4O2/c1-18-8-10-20(11-9-18)23-16-24(21-12-14-22(33-2)15-13-21)29-27(28-23)31-26(32)17-25(30-31)19-6-4-3-5-7-19/h3-17,30H,1-2H3
InChIKey CGQBRVQGIJKMHA-UHFFFAOYSA-N
Molecular Weight 434.499 g/mol
SMILES N1C(=CC(N1c1nc(-c2ccc(OC)cc2)cc(n1)-c1ccc(C)cc1)=O)c1ccccc1
SPLASH splash10-0ugl-9410200000-0e2ca7f32479b510a110
Synonyms 2-[4-(4-Methoxyphenyl)-6-(4-methylphenyl)-2-pyrimidinyl]-5-phenyl-1,2-dihydro-3H-pyrazol-3-one 2-[4-(4-methoxyphenyl)-6-(4-methylphenyl)pyrimidin-2-yl]-5-phenyl-1H-pyrazol-3-one 2-[4-(4-methoxyphenyl)-6-(4-methylphenyl)-2-pyrimidinyl]-5-phenyl-1H-pyrazol-3-one 2-[4-(4-methoxyphenyl)-6-(p-tolyl)pyrimidin-2-yl]-5-phenyl-1H-pyrazol-3-one 2-[4-(4-methoxyphenyl)-6-(p-tolyl)pyrimidin-2-yl]-5-phenyl-3-pyrazolin-3-one
Wiley ID 1469312