Compound Identification
SMILES
CNC1=CC(=C(C=C1)C1=CC2=C3N(CCCC2)[C@H]2CCNC[C@H]2C3=C1)C(F)(F)F
InChIKey
InChIKey=YXAAGCPBRVXKNK-FPOVZHCZSA-N
Formula
C23H26F3N3
Mass
401.477
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzazepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzazepines
Alternative Parents
Trifluoromethylbenzenes Indoles and derivatives Phenylalkylamines Dialkylarylamines Aniline and substituted anilines Secondary alkylarylamines Azepines Piperidines Dialkylamines Azacyclic compounds Organofluorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzazepine - Trifluoromethylbenzene - Indole or derivatives - Tertiary aliphatic/aromatic amine - Phenylalkylamine - Aniline or substituted anilines - Dialkylarylamine - Azepine - Secondary aliphatic/aromatic amine - Aralkylamine - Piperidine - Monocyclic benzene moiety - Benzenoid - Tertiary amine - Azacycle - Secondary amine - Secondary aliphatic amine - Alkyl halide - Organonitrogen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen compound - Alkyl fluoride - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzazepines. These are organic compounds containing a benzene ring fused to an azepine ring (unsaturated seven-membered heterocycle with one nitrogen atom replacing a carbon atom).
External Descriptors
Not available