Compound Identification
SMILES
ClC1=CC(C(=O)C(\C#N)=C2/NC3=CC=CC=C3S2)=C(Cl)S1
InChIKey
InChIKey=ADVXIJIPFFTDJM-RIYZIHGNSA-N
Formula
C14H6Cl2N2OS2
Mass
353.24
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
2,3,5-trisubstituted thiophenes Aryl ketones Aryl thioethers Vinylogous thioesters Aryl chlorides Benzenoids Vinylogous halides Acryloyl compounds Vinylogous amides Thiazoles Enones Heteroaromatic compounds Ketene acetals Azacyclic compounds Nitriles Organic oxides Amines Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-thiazole - 1,2-benzothiazole - 1,3-benzothiazole - Aryl thioether - 2,3,5-trisubstituted thiophene - Aryl ketone - Aryl chloride - Aryl halide - Benzenoid - Vinylogous thioester - Acryloyl-group - Enone - Thiazole - Thiophene - Heteroaromatic compound - Vinylogous amide - Vinylogous halide - Ketone - Ketene acetal or derivatives - Nitrile - Carbonitrile - Azacycle - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - Hydrocarbon derivative - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Cyanide - Organic oxide - 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