For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1H-Imidazole-4,5-dicarboxylic acid 4-[(2-benzoyl-4-chloro-phenyl)-amide] 5-phenylamide
SpectraBase Compound ID 1aQngjXVQ7l
InChI InChI=1S/C24H17ClN4O3/c25-16-11-12-19(18(13-16)22(30)15-7-3-1-4-8-15)29-24(32)21-20(26-14-27-21)23(31)28-17-9-5-2-6-10-17/h1-14H,(H,26,27)(H,28,31)(H,29,32)
InChIKey BMXZHSPIJIZXSI-UHFFFAOYSA-N
Mol Weight 444.88 g/mol
Molecular Formula C24H17ClN4O3
Exact Mass 444.098918 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 6pT64ZZ4dYm
Name 1H-Imidazole-4,5-dicarboxylic acid 4-[(2-benzoyl-4-chloro-phenyl)-amide] 5-phenylamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 444.098918120 u
Formula C24H17ClN4O3
InChI InChI=1S/C24H17ClN4O3/c25-16-11-12-19(18(13-16)22(30)15-7-3-1-4-8-15)29-24(32)21-20(26-14-27-21)23(31)28-17-9-5-2-6-10-17/h1-14H,(H,26,27)(H,28,31)(H,29,32)
InChIKey BMXZHSPIJIZXSI-UHFFFAOYSA-N
Molecular Weight 444.878 g/mol
SMILES C1(=C(C(NC2=CC=CC=C2)=O)NC=N1)C(NC1=C(C(=O)C2=CC=CC=C2)C=C(Cl)C=C1)=O