Compound Identification
SMILES
NS(=O)(=O)C1=C(Cl)C=C2NCN(CC(=O)N(CCCO[N+]([O-])=O)CCCO[N+]([O-])=O)S(=O)(=O)C2=C1
InChIKey
InChIKey=ISSWSXXDUPYWDU-UHFFFAOYSA-N
Formula
C15H21ClN6O11S2
Mass
560.93
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Thiadiazines
- Subclass Benzothiadiazines
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Class
Thiadiazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thiadiazines
Subclass
Benzothiadiazines
Intermediate Tree Nodes
Not available
Direct Parent
1,2,4-benzothiadiazine-1,1-dioxides
Alternative Parents
Alpha amino acids and derivatives Organosulfonamides Aryl chlorides Benzenoids Tertiary carboxylic acid amides Alkyl nitrates Aminosulfonyl compounds Organic nitro compounds Organic nitric acids and derivatives Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Amines Organic zwitterions Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,2,4-benzothiadiazine-1,1-dioxide - Alpha-amino acid or derivatives - Aryl chloride - Aryl halide - Organosulfonic acid amide - Benzenoid - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Alkyl nitrate - Sulfonyl - Tertiary carboxylic acid amide - Aminosulfonyl compound - Organic nitrate - Organic nitric acid or derivatives - Carboxamide group - Organic nitro compound - Azacycle - Carboxylic acid derivative - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organosulfur compound - Organic zwitterion - Organohalogen compound - Organic salt - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1,2,4-benzothiadiazine-1,1-dioxides. These are aromatic heterocyclic compounds containing a 1,2,4-benzothiadiazine ring system with two S=O bonds at the 1-position.
External Descriptors
Not available