Compound Identification
SMILES
CC1=CN(CC2=CC(NC(=O)C3CN(CCN3)C3C4=C(CCC5=CC(Br)=CN=C35)C=C(Cl)C=C4)=CC=C2)C=N1
InChIKey
InChIKey=ZRJYXJPDLNZBGH-UHFFFAOYSA-N
Formula
C30H30BrClN6O
Mass
605.97
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 acid amides Piperazine carboxamides Anilides N-arylamides Aralkylamines N-alkylpiperazines Pyridines and derivatives N-substituted imidazoles Aryl bromides Aryl chlorides Heteroaromatic compounds Trialkylamines Secondary carboxylic acid amides Dialkylamines Azacyclic compounds Organochlorides Hydrocarbon derivatives Organic oxides Organobromides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzocycloheptapyridine - Alpha-amino acid amide - Alpha-amino acid or derivatives - Piperazine-2-carboxamide - Anilide - N-arylamide - N-alkylpiperazine - Aralkylamine - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - 1,4-diazinane - N-substituted imidazole - Piperazine - Pyridine - Benzenoid - Azole - Heteroaromatic compound - Imidazole - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Secondary amine - Azacycle - Carboxylic acid derivative - Secondary aliphatic amine - Carbonyl group - Organic oxide - Organohalogen compound - Organic oxygen compound - Amine - Hydrocarbon derivative - Organobromide - Organochloride - Organooxygen compound - Organic nitrogen compound - Organonitrogen compound - 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