Compound Identification
SMILES
C[C@@H]1C2=CC=CC=C2[C@H]2C[C@@H](CCN2C2=C1C=C(C=C2)C1=NC=NC=C1)NC(=O)C(F)(F)F
InChIKey
InChIKey=AIKGAMQBVQMTKE-QDOIMOTRSA-N
Formula
C25H23F3N4O
Mass
452.481
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzazepines
- Subclass Dibenzazepines
-
Class
Benzazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzazepines
Subclass
Dibenzazepines
Intermediate Tree Nodes
Not available
Direct Parent
Dibenzazepines
Alternative Parents
Dialkylarylamines Azepines Aralkylamines Pyrimidines and pyrimidine derivatives Piperidines Benzenoids Heteroaromatic compounds Secondary carboxylic acid amides Amino acids and derivatives Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Dibenzazepine - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Azepine - Aralkylamine - Piperidine - Pyrimidine - Benzenoid - Heteroaromatic compound - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Azacycle - Carboxylic acid derivative - Amine - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxygen compound - Organooxygen compound - Alkyl fluoride - Carbonyl group - Organic nitrogen compound - Alkyl halide - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as dibenzazepines. These are compounds with two benzene rings connected by an azepine ring. Azepine is an unsaturated seven-member heterocycle with one nitrogen atom replacing a carbon atom.
External Descriptors
Not available