Compound Identification
SMILES
ClC1=C(SC2=CC=CC=C12)C(=O)N(CC1=CC(Br)=CC=C1)C1CCS(=O)(=O)C1
InChIKey
InChIKey=BEPRAGRCMYSLMH-UHFFFAOYSA-N
Formula
C20H17BrClNO3S2
Mass
498.83
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzothiophenes
- Subclass 1-benzothiophenes
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Class
Benzothiophenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzothiophenes
Subclass
1-benzothiophenes
Intermediate Tree Nodes
Not available
Direct Parent
1-benzothiophenes
Alternative Parents
2-heteroaryl carboxamides Thiophene carboxamides Bromobenzenes Aryl bromides Aryl chlorides Vinylogous halides Thiolanes Tertiary carboxylic acid amides Sulfones Heteroaromatic compounds Hydrocarbon derivatives Organic oxides Organobromides Organochlorides Organonitrogen compounds Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-benzothiophene - 2-heteroaryl carboxamide - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - Bromobenzene - Halobenzene - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Vinylogous halide - Sulfone - Tertiary carboxylic acid amide - Thiolane - Thiophene - Carboxamide group - Carboxylic acid derivative - Organochloride - Organobromide - Organohalogen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1-benzothiophenes. These are aromatic heterocyclic compound containing the Benzo[b]thiophene ring system.
External Descriptors
Not available