Compound Identification
SMILES
[O-][N+]([O-])=O.ClC1=C(NC2=NCCN2)C2=NSN=C2C=C1
InChIKey
InChIKey=OEPQZRAYFSWQKY-UHFFFAOYSA-N
Formula
C9H8ClN6O3S
Mass
315.71
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzothiadiazoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzothiadiazoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzothiadiazoles
Alternative Parents
Aryl chlorides Benzenoids Thiadiazoles Heteroaromatic compounds Imidazolines Organic nitrates Guanidines Organic nitro compounds Organic nitric acids Carboximidamides Azacyclic compounds Hydrocarbon derivatives Organic oxides Amines Organic salts Organochlorides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2,1,3-benzothiadiazole - Aryl chloride - Aryl halide - Benzenoid - Azole - Heteroaromatic compound - 2-imidazoline - Organic nitrate - Thiadiazole - Guanidine - Organic nitro compound - Organic nitric acid - Organic nitric acid or derivatives - Azacycle - Carboximidamide - Organochloride - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organic salt - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzothiadiazoles. These are heterocyclic aromatic compounds containing a benzene ring fused to a thiadiazole ring. Thiadiazole is a five-membered aromatic heterocycle made up of one sulfur atom and two nitrogen atoms.
External Descriptors
Not available