Compound Identification
SMILES
COC1=CC=C(\C=C\C(=O)C2=CC=C(NC(=O)C3=C(Cl)C4=CC=CC=C4S3)C=C2)C=C1
InChIKey
InChIKey=QKPYTOLVIOGCIJ-OVCLIPMQSA-N
Formula
C25H18ClNO3S
Mass
447.93
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-benzothiophene-2-carboxanilides
Alternative Parents
Retrochalcones Aromatic anilides Cinnamic acids and derivatives 2-heteroaryl carboxamides Thiophene carboxamides Styrenes Phenoxy compounds Anisoles Aryl ketones Benzoyl derivatives Methoxybenzenes Alkyl aryl ethers Aryl chlorides Enones Vinylogous halides Acryloyl compounds Heteroaromatic compounds Secondary carboxylic acid amides Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds Organopnictogen compounds Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-benzothiophene-2-carboxanilide - Retrochalcone - Linear 1,3-diarylpropanoid - Aromatic anilide - Cinnamic acid or derivatives - Anisole - Benzoyl - 2-heteroaryl carboxamide - Phenol ether - Styrene - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - Phenoxy compound - Aryl ketone - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Aryl halide - Aryl chloride - Heteroaromatic compound - Vinylogous halide - Alpha,beta-unsaturated ketone - Thiophene - Enone - Acryloyl-group - Ketone - Carboxamide group - Secondary carboxylic acid amide - Ether - Carboxylic acid derivative - Organohalogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Aldehyde - Organic oxide - Organopnictogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1-benzothiophene-2-carboxanilides. These are aromatic heteropolycyclic compounds that contain a 1-benzothiophene ring system, which is substituted with an anilide at the 2-position.
External Descriptors
Not available