Compound Identification
SMILES
[O-][N+](=O)C1=CN=C(NC(=O)C2=C(Cl)C3=CC=CC=C3S2)S1
InChIKey
InChIKey=MINQMXCUJQNIEV-UHFFFAOYSA-N
Formula
C12H6ClN3O3S2
Mass
339.77
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzothiophenes
- Subclass 1-benzothiophenes
-
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
Thiophene carboxamides 2-heteroaryl carboxamides Nitroaromatic compounds Nitrothiazoles 2,5-disubstituted thiazoles Aryl chlorides Benzenoids Vinylogous halides Heteroaromatic compounds Secondary carboxylic acid amides Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Hydrocarbon derivatives Organic zwitterions Organochlorides Organooxygen compounds Organic salts Organonitrogen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-benzothiophene - 2-heteroaryl carboxamide - Nitroaromatic compound - Thiophene carboxylic acid or derivatives - Thiophene carboxamide - Nitrothiazole - 2,5-disubstituted 1,3-thiazole - Aryl chloride - Aryl halide - Benzenoid - Azole - Thiophene - Heteroaromatic compound - Thiazole - Vinylogous halide - Secondary carboxylic acid amide - Organic nitro compound - C-nitro compound - Carboxamide group - Azacycle - Carboxylic acid derivative - Organic 1,3-dipolar compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxide - Organohalogen compound - Organic oxygen compound - Organic salt - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic zwitterion - 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