Compound Identification
SMILES
[O-][Cl](=O)(=O)=O.OC(=O)C1=CC=C(C=C1)[N+]1=CC2=C(CCCC2)S1
InChIKey
InChIKey=HIOSHKXFFMDTRA-UHFFFAOYSA-N
Formula
C14H14ClNO6S
Mass
359.78
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
Benzoic acids Benzoyl derivatives Organic perchlorates Organic perchlorate salts Thiazoles Heteroaromatic compounds Carboxylic acids Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic zwitterions Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoic acid or derivatives - Benzoic acid - 1,2-benzothiazole - Benzoyl - Monocyclic benzene moiety - Organic perchlorate salt - Benzenoid - Organic perchlorate - Azole - Heteroaromatic compound - Thiazole - Organic chlorate - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organic oxygen compound - Organic nitrogen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Organic zwitterion - Organooxygen compound - Organonitrogen compound - 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