Compound Identification
SMILES
COC(=O)C1=CC=CC=C1C1=CC=C(C=C1)N1C(=NC2=C(C)C(Br)=CN=C12)C1CC1
InChIKey
InChIKey=JFRLPPCJNVUSEB-UHFFFAOYSA-N
Formula
C24H20BrN3O2
Mass
462.347
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Biphenyls and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Biphenyls and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Biphenyls and derivatives
Alternative Parents
Phenylimidazoles Benzoic acid esters Imidazopyridines Benzoyl derivatives Methylpyridines N-substituted imidazoles Aryl bromides Methyl esters Heteroaromatic compounds Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Biphenyl - 1-phenylimidazole - Benzoate ester - Benzoic acid or derivatives - Imidazopyridine - Benzoyl - Methylpyridine - Aryl bromide - Aryl halide - Pyridine - N-substituted imidazole - Azole - Heteroaromatic compound - Methyl ester - Imidazole - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organobromide - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as biphenyls and derivatives. These are organic compounds containing to benzene rings linked together by a C-C bond.
External Descriptors
Not available