Compound Identification
SMILES
O=C1NC2=C(C(=O)N=CN2)C2(NC3=CC=CC=C3S2)N1
InChIKey
InChIKey=KHHJVQUZGLHIDL-UHFFFAOYSA-N
Formula
C12H9N5O2S
Mass
287.3
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
Pyrimidones Alkylarylthioethers Benzenoids Vinylogous amides Thiazoles Heteroaromatic compounds Ureas Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzo-thiazole - 1,2-benzothiazole - 1,3-benzothiazole - Aryl thioether - Pyrimidone - Alkylarylthioether - Pyrimidine - Benzenoid - Heteroaromatic compound - Vinylogous amide - Thiazole - Urea - Azacycle - Thioether - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen 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