Compound Identification
SMILES
CNC(=O)C1=C(NC2=NC(NC3=CC4=C(C=C3)C(C)(C)CC(NC(=O)OC)C(=O)N4)=NC=C2Cl)C(F)=CC=C1
InChIKey
InChIKey=XMKAFTZMVDNUII-UHFFFAOYSA-N
Formula
C26H27ClFN7O4
Mass
556.0
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
3-halobenzoic acids and derivatives Alpha amino acids and derivatives Benzamides Benzoyl derivatives Aniline and substituted anilines Azepines Fluorobenzenes Halopyrimidines Aminopyrimidines and derivatives Aryl chlorides Imidolactams Aryl fluorides Heteroaromatic compounds Vinylogous amides Methylcarbamates Secondary carboxylic acid amides Lactams Secondary amines Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Carbonyl compounds Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzazepine - Alpha-amino acid or derivatives - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Benzoyl - Aniline or substituted anilines - Aminopyrimidine - Azepine - Fluorobenzene - Halobenzene - Halopyrimidine - Imidolactam - Pyrimidine - Benzenoid - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Carbamic acid ester - Vinylogous amide - Methylcarbamate - Heteroaromatic compound - Secondary carboxylic acid amide - Amino acid or derivatives - Lactam - Carboxamide group - Azacycle - Secondary amine - Carboxylic acid derivative - Carbonyl group - Organooxygen compound - Organohalogen compound - Hydrocarbon derivative - Organic oxygen compound - Organochloride - Organofluoride - Organonitrogen compound - Amine - Organic oxide - 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