Compound Identification
SMILES
O=S(=O)(N1CC[NH+]2CCC[C@@H]2C1)C1=CC=CC2=NSN=C12
InChIKey
InChIKey=ILXPDKSMWMDWNY-SNVBAGLBSA-O
Formula
C13H17N4O2S2
Mass
325.42
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
N-alkylpiperazines Organosulfonamides N-alkylpyrrolidines Benzenoids Thiadiazoles Sulfonyls Quaternary ammonium salts Heteroaromatic compounds Trialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2,1,3-benzothiadiazole - N-alkylpiperazine - 1,4-diazinane - Piperazine - Organosulfonic acid amide - N-alkylpyrrolidine - Benzenoid - Azole - Pyrrolidine - Quaternary ammonium salt - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Thiadiazole - Heteroaromatic compound - Tertiary aliphatic amine - Azacycle - Organic nitrogen compound - Amine - Organic oxygen compound - Hydrocarbon derivative - Organonitrogen compound - Organosulfur compound - Organic oxide - 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