Compound Identification
SMILES
COC1=CC=C(CN(C2CCS(=O)(=O)C2)C(=O)C2=C(Cl)C3=C(S2)C=C(Cl)C=C3)C=C1
InChIKey
InChIKey=FLFOQWGGRUAZQB-UHFFFAOYSA-N
Formula
C21H19Cl2NO4S2
Mass
484.41
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 Anisoles Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Aryl chlorides Vinylogous halides Thiolanes Tertiary carboxylic acid amides Sulfones Heteroaromatic compounds Hydrocarbon derivatives Organonitrogen compounds Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-benzothiophene - 2-heteroaryl carboxamide - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - Alkyl aryl ether - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Vinylogous halide - Sulfone - Tertiary carboxylic acid amide - Thiolane - Thiophene - Carboxamide group - Ether - Carboxylic acid derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - 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