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(E)-4-(((1-benzoyl-1H-indol-3-yl)methylene)amino)-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
SpectraBase Compound ID 85CcFIPRO6z
InChI InChI=1S/C27H22N4O2/c1-19-25(27(33)31(29(19)2)22-13-7-4-8-14-22)28-17-21-18-30(24-16-10-9-15-23(21)24)26(32)20-11-5-3-6-12-20/h3-18H,1-2H3/b28-17+
InChIKey XURGLESUGRETAB-OGLMXYFKSA-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 24p7FJQZFxK
Name (E)-4-(((1-benzoyl-1H-indol-3-yl)methylene)amino)-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H22N4O2
InChI InChI=1S/C27H22N4O2/c1-19-25(27(33)31(29(19)2)22-13-7-4-8-14-22)28-17-21-18-30(24-16-10-9-15-23(21)24)26(32)20-11-5-3-6-12-20/h3-18H,1-2H3/b28-17+
InChIKey XURGLESUGRETAB-OGLMXYFKSA-N
Literature Reference DOI 10.1016/j.ejmech.2016.08.013
Molecular Weight 434.499 g/mol
SMILES c1ccc2c(c1)c(c[n]2C(c1ccccc1)=O)\C=N\C1=C(N(N(C1=O)c1ccccc1)C)C
SPLASH splash10-02br-4954000000-b68568550d8df575b8c9
Source of Spectrum Phoebe F. Lamie, et al. European Journal of Medicinal Chemistry, 10.1016/j.ejmech.2016.08.013
Wiley ID 1815269