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(4Z)-5-methyl-2-(4-methylphenyl)-4-{[4-(4-morpholinylcarbonyl)anilino]methylene}-2,4-dihydro-3H-pyrazol-3-one
SpectraBase Compound ID Fy08LikIoxG
InChI InChI=1S/C23H24N4O3/c1-16-3-9-20(10-4-16)27-23(29)21(17(2)25-27)15-24-19-7-5-18(6-8-19)22(28)26-11-13-30-14-12-26/h3-10,15,24H,11-14H2,1-2H3/b21-15-
InChIKey XSPHHJCBJOZEKZ-QNGOZBTKSA-N
Mol Weight 404.47 g/mol
Molecular Formula C23H24N4O3
Exact Mass 404.184841 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9fqPBHcvSyq
Name (4Z)-5-Methyl-2-(4-methylphenyl)-4-{[4-(4-morpholinylcarbonyl)anilino]methylene}-2,4-dihydro-3H-pyrazol-3-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 404.184840646 u
Formula C23H24N4O3
InChI InChI=1S/C23H24N4O3/c1-16-3-9-20(10-4-16)27-23(29)21(17(2)25-27)15-24-19-7-5-18(6-8-19)22(28)26-11-13-30-14-12-26/h3-10,15,24H,11-14H2,1-2H3/b21-15-
InChIKey XSPHHJCBJOZEKZ-QNGOZBTKSA-N
Molecular Weight 404.470 g/mol
SMILES N(\C=C/1C(N(N=C1C)C=1C=CC(C)=CC1)=O)C1=CC=C(C(N2CCOCC2)=O)C=C1