Compound Identification
SMILES
COCCC(CCOC)S(=O)(=O)C1=CC=C(NC2=NC3=NC=C(C#N)C(NC4=CC(Cl)=C(F)C=C4)=C3S2)C=C1
InChIKey
InChIKey=RMOKRFIGJYKHBC-UHFFFAOYSA-N
Formula
C26H25ClFN5O4S2
Mass
590.09
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
Aniline and substituted anilines Aminopyridines and derivatives Chlorobenzenes Fluorobenzenes 2-amino-1,3-thiazoles Primary aromatic amines Aryl chlorides Aryl fluorides Sulfones Heteroaromatic compounds Dialkyl ethers Nitriles Azacyclic compounds Secondary amines Organic oxides Organochlorides Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzenesulfonyl group - Aniline or substituted anilines - Aminopyridine - Halobenzene - Fluorobenzene - Chlorobenzene - Primary aromatic amine - Pyridine - Aryl chloride - Aryl fluoride - Aryl halide - 1,3-thiazol-2-amine - Sulfone - Sulfonyl - Thiazole - Azole - Heteroaromatic compound - Azacycle - Dialkyl ether - Ether - Organoheterocyclic compound - Secondary amine - Carbonitrile - Nitrile - Organic oxide - Cyanide - Organic oxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteropolycyclic 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