Compound Identification
SMILES
CC1=CC=C(C=C1)N1C(=O)N(CC2=C(F)C=C(Br)C=C2)C2=CC=CC=C2S1(=O)=O
InChIKey
InChIKey=GPRKOOSEKCRSOE-UHFFFAOYSA-N
Formula
C21H16BrFN2O3S
Mass
475.33
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
Sulfanilides Toluenes Sulfonylureas Fluorobenzenes Bromobenzenes Aryl fluorides Aryl bromides Organosulfonic acids and derivatives Azacyclic compounds Organofluorides Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,2,4-benzothiadiazine-1,1-dioxide - Sulfanilide - Toluene - Sulfonylurea - Bromobenzene - Fluorobenzene - Halobenzene - Aryl bromide - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Azacycle - Organic nitrogen compound - Organobromide - Organohalogen compound - Organofluoride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - 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