Compound Identification
SMILES
[Na+].ClC1=CC2=C(C=C1)C(=O)[N-]S2(=O)=O
InChIKey
InChIKey=MZQVFKRQXKFJFT-UHFFFAOYSA-M
Formula
C7H3ClNNaO3S
Mass
239.6
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzothiazoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzothiazoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzothiazoles
Alternative Parents
Benzenoids Aryl chlorides Organosulfonic acids and derivatives Organic metal halides Carboxylic acids and derivatives Carbene-type 1,3-dipolar compounds Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organochlorides Organic sodium salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,2-benzothiazole - Aryl chloride - Aryl halide - Benzenoid - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organic metal halide - Carboxylic acid derivative - Azacycle - Carbene-type 1,3-dipolar compound - Organic 1,3-dipolar compound - Organic alkali metal salt - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organochloride - Organic oxygen compound - Organic nitrogen compound - Organic salt - Organic sodium salt - Organohalogen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzothiazoles. These are organic compounds containing a benzene fused to a thiazole ring (a five-membered ring with four carbon atoms, one nitrogen atom and one sulfur atom).
External Descriptors
Not available