Compound Identification
SMILES
OC(=O)C1=CC=CC=C1C1=CC=C(O1)C=C1C(=O)N=C2SC3=CC=CC=C3N2C1=N
InChIKey
InChIKey=HWSFWEIBWNARGC-UHFFFAOYSA-N
Formula
C22H13N3O4S
Mass
415.42
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 Aryl thioethers Benzoyl derivatives Pyrimidones Imidolactams Hydropyrimidines Thiazoles Heteroaromatic compounds Furans N-acylimines Isothioureas Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Carboxylic acids Carboxamidines Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoic acid or derivatives - Benzoic acid - Benzo-thiazole - 1,3-benzothiazole - 1,2-benzothiazole - Benzoyl - Aryl thioether - Pyrimidone - Imidolactam - Monocyclic benzene moiety - Benzenoid - Pyrimidine - Hydropyrimidine - 1,4,5,6-tetrahydropyrimidine - Furan - Thiazole - Heteroaromatic compound - N-acylimine - Isothiourea - Amidine - Oxacycle - Azacycle - Organic 1,3-dipolar compound - Carboxylic acid amidine - Carboxylic acid derivative - Carboxylic acid - Propargyl-type 1,3-dipolar organic compound - Organic oxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - 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