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2-[1-Phenyl-3-phenylcarbamoyl-5-methylpyrazol-4-yl]-perimidine
SpectraBase Compound ID KNCUBMJ1EVk
InChI InChI=1S/C28H21N5O/c1-18-24(27-30-22-16-8-10-19-11-9-17-23(31-27)25(19)22)26(28(34)29-20-12-4-2-5-13-20)32-33(18)21-14-6-3-7-15-21/h2-17H,1H3,(H,29,34)(H,30,31)
InChIKey OBAJCKPRGVAFHV-UHFFFAOYSA-N
Mol Weight 443.51 g/mol
Molecular Formula C28H21N5O
Exact Mass 443.17461 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2AamJuSpOa
Name 2-[1-Phenyl-3-phenylcarbamoyl-5-methylpyrazol-4-yl]-perimidine
Alternate Name(s) 5-Methyl-4-(1H-perimidin-2-yl)-N,1-diphenyl-1H-pyrazole-3-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H21N5O
InChI InChI=1S/C28H21N5O/c1-18-24(27-30-22-16-8-10-19-11-9-17-23(31-27)25(19)22)26(28(34)29-20-12-4-2-5-13-20)32-33(18)21-14-6-3-7-15-21/h2-17H,1H3,(H,29,34)(H,30,31)
InChIKey OBAJCKPRGVAFHV-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.201200486
Molecular Weight 443.510 g/mol
SMILES N1C(c2c([n](nc2C(=O)Nc2ccccc2)-c2ccccc2)C)=Nc2cccc3cccc1c23
SPLASH splash10-0udl-4309600000-2c062109e725450141ef
Source of Spectrum APC-346-399-8a
Wiley ID 1769514