Compound Identification
SMILES
ClC1=CC=CC(=C1)C1=CC=C(O1)C(=O)NC(=S)NC1=NC2=C(S1)C=C(C=C2)N1CCOCC1
InChIKey
InChIKey=KHANRZOONPSJMB-UHFFFAOYSA-N
Formula
C23H19ClN4O3S2
Mass
499.0
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
Furoic acid and derivatives Dialkylarylamines Chlorobenzenes Morpholines Aryl chlorides Thiazoles Heteroaromatic compounds Thioureas Amino acids and derivatives Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Furoic acid or derivatives - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Halobenzene - Chlorobenzene - Morpholine - Aryl chloride - Oxazinane - Aryl halide - Benzenoid - Monocyclic benzene moiety - Thiazole - Furan - Azole - Heteroaromatic compound - Tertiary amine - Thiourea - Amino acid or derivatives - Oxacycle - Azacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Organic oxygen compound - Organosulfur compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - 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