Compound Identification
SMILES
CC(C)C1=NOC(=N1)C1CCN(CC1)C1=C(C(NC2=C(F)C=C(C=C2)S(C)(=O)=O)=NC=N1)[N+]([O-])=O
InChIKey
InChIKey=DGBKNTVAKIFYNU-UHFFFAOYSA-N
Formula
C21H24FN7O5S
Mass
505.53
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
- Subclass Benzenesulfonyl compounds
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Class
Benzene and substituted derivatives
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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 Dialkylarylamines Nitroaromatic compounds Aminopyrimidines and derivatives Fluorobenzenes Piperidines Aryl fluorides Imidolactams Sulfones Heteroaromatic compounds 1,2,4-oxadiazoles Oxacyclic compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organic zwitterions Organooxygen compounds Organic salts Organofluorides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzenesulfonyl group - Dialkylarylamine - Nitroaromatic compound - Aniline or substituted anilines - Aminopyrimidine - Halobenzene - Fluorobenzene - Pyrimidine - Imidolactam - Piperidine - Aryl halide - Aryl fluoride - Azole - Sulfone - Sulfonyl - 1,2,4-oxadiazole - Oxadiazole - Heteroaromatic compound - Organic nitro compound - C-nitro compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Oxacycle - Azacycle - Organic oxoazanium - Organic zwitterion - Organofluoride - Organonitrogen compound - Organohalogen compound - Amine - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic salt - 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