Compound Identification
SMILES
ClC1=CC2=C(C=C1)C(N1CCN([C@H](C1)C(=O)NCCN1C=CN=C1)C(=O)NC1CCCCC1)C1=NC=C(Br)C=C1CC2
InChIKey
InChIKey=JKNGYLAGBYMPSO-SCBLGKRXSA-N
Formula
C31H37BrClN7O2
Mass
655.04
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzocycloheptapyridines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzocycloheptapyridines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzocycloheptapyridines
Alternative Parents
Alpha amino acids and derivatives Piperazine carboxamides Aralkylamines N-alkylpiperazines Pyridines and derivatives Aryl bromides N-substituted imidazoles Aryl chlorides Benzenoids Heteroaromatic compounds Ureas Trialkylamines Secondary carboxylic acid amides Azacyclic compounds Organochlorides Hydrocarbon derivatives Organic oxides Organobromides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzocycloheptapyridine - Alpha-amino acid or derivatives - Piperazine-2-carboxamide - Piperazine-1-carboxamide - Aralkylamine - N-alkylpiperazine - 1,4-diazinane - Aryl bromide - Aryl chloride - N-substituted imidazole - Benzenoid - Aryl halide - Piperazine - Pyridine - Imidazole - Heteroaromatic compound - Azole - Urea - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organohalogen compound - Organobromide - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzocycloheptapyridines. These are aromatic compounds containing a benzene ring and a pyridine ring fused to a seven membered carbocycle.
External Descriptors
Not available