Compound Identification
SMILES
CN1CCCC1CCSC1=NC2=C(S1)C=CC(Cl)=C2
InChIKey
InChIKey=IUQVEZDPSSNXOR-UHFFFAOYSA-N
Formula
C14H17ClN2S2
Mass
312.87
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
Alkylarylthioethers N-alkylpyrrolidines Benzenoids Aryl chlorides Thiazoles Heteroaromatic compounds Trialkylamines Sulfenyl compounds Azacyclic compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Aryl thioether - Alkylarylthioether - Aryl chloride - Aryl halide - N-alkylpyrrolidine - Benzenoid - Azole - Heteroaromatic compound - Pyrrolidine - Thiazole - Tertiary amine - Tertiary aliphatic amine - Thioether - Sulfenyl compound - Azacycle - Hydrocarbon derivative - Organic nitrogen compound - Organosulfur compound - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - 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