Compound Identification
SMILES
BrC1CCS(=O)(=O)C2=CC=CC=C2C1=O
InChIKey
InChIKey=MEFXYKSUVZWYGH-UHFFFAOYSA-N
Formula
C10H9BrO3S
Mass
289.14
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzothiepins
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzothiepins
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzothiepins
Alternative Parents
Aryl alkyl ketones Benzenoids Sulfones Alpha-haloketones Organobromides Organic oxides Hydrocarbon derivatives Alkyl bromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzothiepin - Aryl alkyl ketone - Aryl ketone - Benzenoid - Alpha-haloketone - Sulfone - Ketone - Organic oxide - Organooxygen compound - Organobromide - Organohalogen compound - Alkyl bromide - Organic oxygen compound - Alkyl halide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzothiepins. These are organic compounds containing a benzene fused to a thiepine ring (a seven-membered ring with six carbon atoms and one sulfur atom).
External Descriptors
Not available