Compound Identification
SMILES
OCCNC1=NC(N2CCC3=CC=CC=C3CC2)=C(C#N)C(OCC(F)(F)F)=N1
InChIKey
InChIKey=BRJWSWOUTCHPTG-UHFFFAOYSA-N
Formula
C19H20F3N5O2
Mass
407.397
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
Dialkylarylamines Azepines Aminopyrimidines and derivatives Alkyl aryl ethers Imidolactams Benzenoids Heteroaromatic compounds Nitriles Azacyclic compounds Alkanolamines Primary alcohols Organofluorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzazepine - Dialkylarylamine - Alkyl aryl ether - Aminopyrimidine - Azepine - Imidolactam - Benzenoid - Pyrimidine - Heteroaromatic compound - Alkanolamine - Azacycle - Ether - Carbonitrile - Nitrile - Alcohol - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Primary alcohol - Hydrocarbon derivative - Cyanide - Amine - Alkyl halide - Alkyl fluoride - Organic oxygen compound - Organic nitrogen compound - 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