Compound Identification
SMILES
ClC1=CC(Br)=C2[C@@H](C3CCN(CC3)C(=O)CN3CCC4(CC3)SCCS4)C3=NC=C(Br)C=C3CCC2=C1
InChIKey
InChIKey=HAICRZJFRPMSMB-AREMUKBSSA-N
Formula
C28H32Br2ClN3OS2
Mass
685.96
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 Azaspirodecane derivatives N-acylpiperidines Dithioketals Pyridines and derivatives Aryl bromides Aryl chlorides Benzenoids Tertiary carboxylic acid amides 1,3-dithiolanes Heteroaromatic compounds Trialkylamines Azacyclic compounds Dialkylthioethers Organochlorides Hydrocarbon derivatives Organic oxides Organobromides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzocycloheptapyridine - Alpha-amino acid or derivatives - Azaspirodecane - N-acyl-piperidine - Dithioketal - Aryl bromide - Aryl chloride - Benzenoid - Aryl halide - Piperidine - Pyridine - Thioacetal - Dithiolane - Heteroaromatic compound - 1,3-dithiolane - Tertiary carboxylic acid amide - Carboxamide group - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Dialkylthioether - Azacycle - Thioether - 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