Compound Identification
SMILES
CS(=O)(=O)C1=CC=CC=C1CNC(=O)CN1C(Cl)=CN=C(NCC(F)(F)C2=CC=CC=[N+]2[O-])C1=O
InChIKey
InChIKey=BCMSPTZSQNQYTD-UHFFFAOYSA-N
Formula
C21H20ClF2N5O5S
Mass
527.93
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzenesulfonyl compounds
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzenesulfonyl compounds
Intermediate Tree Nodes
Not available
Direct Parent
Benzenesulfonyl compounds
Alternative Parents
Aminopyrazines Pyridinium derivatives Aryl chlorides Imidolactams Sulfones Heteroaromatic compounds Secondary carboxylic acid amides Lactams Azacyclic compounds Organic oxides Hydrocarbon derivatives Organic salts Carbonyl compounds Alkyl fluorides Organochlorides Organofluorides Amines Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzenesulfonyl group - Aminopyrazine - Aryl chloride - Aryl halide - Pyrazine - Pyridine - Pyridinium - Imidolactam - Heteroaromatic compound - Sulfonyl - Sulfone - Secondary carboxylic acid amide - Carboxamide group - Lactam - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic oxide - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organochloride - Organohalogen compound - Amine - Organic nitrogen compound - Carbonyl group - Alkyl halide - Organic salt - Alkyl fluoride - Hydrocarbon derivative - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzenesulfonyl compounds. These are aromatic compounds containing a benzenesulfonyl group, which consists of a monocyclic benzene moiety that carries a sulfonyl group.
External Descriptors
Not available