Compound Identification
SMILES
OC1=CC=CC=C1\C=C1/SC(=S)N(NC2=NS(=O)(=O)C3=CC=CC=C23)C1=O
InChIKey
InChIKey=DIWBQRDEDUNGMK-LCYFTJDESA-N
Formula
C17H11N3O4S3
Mass
417.47
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
1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Thiazolidinethiones Imidolactams Benzene and substituted derivatives Organosulfonic acids and derivatives Carboxylic acid hydrazides Amidrazones Azacyclic compounds Amidines Organosulfur compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,2-benzothiazole - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Monocyclic benzene moiety - Imidolactam - Benzenoid - Thiazolidinethione - Thiazolidine - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Carboxylic acid amidrazone - Carboxylic acid hydrazide - Amidine - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Organooxygen compound - Organosulfur 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