Compound Identification
SMILES
OC1=C(C(N(C2=NC3=C(S2)C=C(Cl)C=C3)C1=O)C1=CC=NC=C1)C(=O)C1=CC2=CC=CC=C2O1
InChIKey
InChIKey=IXKQIHYQSDBKKL-UHFFFAOYSA-N
Formula
C25H14ClN3O4S
Mass
487.91
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
Benzofurans Pyrroline carboxylic acids and derivatives Aryl ketones Pyridines and derivatives Aryl chlorides Benzenoids Vinylogous acids Thiazoles Tertiary carboxylic acid amides Furans Heteroaromatic compounds Lactams Oxacyclic compounds Enols Azacyclic compounds Organic oxides Organochlorides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Benzofuran - Pyrroline carboxylic acid or derivatives - Aryl ketone - Aryl chloride - Benzenoid - Pyridine - Aryl halide - Heteroaromatic compound - Vinylogous acid - Thiazole - Tertiary carboxylic acid amide - Pyrroline - Furan - Azole - Carboxamide group - Ketone - Lactam - Oxacycle - Azacycle - Carboxylic acid derivative - Enol - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen 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