Compound Identification
SMILES
CCC1=NC(Cl)=C(N1CC1=CC2=C(OC(=C2Br)C2=CC=CC=C2N)C=C1)C(=O)NC
InChIKey
InChIKey=UIDNFJOREQHADT-UHFFFAOYSA-N
Formula
C22H20BrClN4O2
Mass
487.78
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
2-arylbenzofuran flavonoids
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
2-arylbenzofuran flavonoids
Alternative Parents
2-phenylbenzofurans 1,2,4,5-tetrasubstituted imidazoles 2-heteroaryl carboxamides Aniline and substituted anilines Carbonylimidazoles Primary aromatic amines N-substituted imidazoles Aryl bromides Aryl chlorides Vinylogous halides Heteroaromatic compounds Furans Secondary carboxylic acid amides Amino acids and derivatives Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organobromides Organochlorides Organooxygen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-arylbenzofuran flavonoid - 2-phenylbenzofuran - Phenylbenzofuran - 1,2,4,5-tetrasubstituted imidazole - Benzofuran - 2-heteroaryl carboxamide - Aniline or substituted anilines - Imidazole-4-carbonyl group - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - N-substituted imidazole - Primary aromatic amine - Benzenoid - Vinylogous halide - Heteroaromatic compound - Azole - Furan - Imidazole - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Azacycle - Oxacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organochloride - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organopnictogen compound - Amine - Organic oxide - Primary amine - Hydrocarbon derivative - Organohalogen compound - Organobromide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2-arylbenzofuran flavonoids. These are phenylpropanoids containing the 2-phenylbenzofuran moiety.
External Descriptors
Not available