Compound Identification
SMILES
OS(=O)(=O)C1=CC(=O)C2=C(NNC3=C(C=CC(NC4=C(Cl)C(F)=NC(F)=N4)=C3)S(O)(=O)=O)C(=N)C=CC2=C1
InChIKey
InChIKey=GZURBSBOOILIPG-UHFFFAOYSA-N
Formula
C20H13ClF2N6O7S2
Mass
586.93
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzenesulfonic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzenesulfonic acids and derivatives
Alternative Parents
1-sulfo,2-unsubstituted aromatic compounds Benzenesulfonyl compounds Phenylhydrazines Aniline and substituted anilines 2-halopyrimidines Aminopyrimidines and derivatives Aryl chlorides Aryl fluorides Imidolactams Heteroaromatic compounds Sulfonyls Vinylogous amides Organosulfonic acids Ketimines Ketones Secondary amines Azacyclic compounds Hydrocarbon derivatives Hydrazines and derivatives Organofluorides Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzenesulfonate - Benzenesulfonyl group - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Phenylhydrazine - Aniline or substituted anilines - Aminopyrimidine - 2-halopyrimidine - Halopyrimidine - Aryl chloride - Aryl fluoride - Aryl halide - Pyrimidine - Imidolactam - Heteroaromatic compound - Vinylogous amide - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Ketone - Ketimine - Azacycle - Organoheterocyclic compound - Secondary amine - Organochloride - Organohalogen compound - Organosulfur compound - Imine - Hydrazine derivative - Organic nitrogen compound - Carbonyl group - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzenesulfonic acids and derivatives. These are organic compounds containing a sulfonic acid or a derivative thereof that is linked to a benzene ring.
External Descriptors
Not available