Compound Identification
SMILES
OCC1=CN(C[C@H]2CN(C(=O)O2)C2=CC(F)=C(C=C2)C2=CCS(=O)(=O)CC2)N=N1
InChIKey
InChIKey=XCZKJPSTHDFBDB-HNNXBMFYSA-N
Formula
C18H19FN4O5S
Mass
422.43
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Halobenzenes
- Level 5 Fluorobenzenes
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Subclass
Halobenzenes
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Halobenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Fluorobenzenes
Alternative Parents
Thiopyrans Aryl fluorides Oxazolidinones Triazoles Sulfones Carbamate esters Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds Organofluorides Organonitrogen compounds Primary alcohols Aromatic alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Fluorobenzene - Aryl fluoride - Aryl halide - Oxazolidinone - Thiopyran - Azole - Heteroaromatic compound - Oxazolidine - Sulfone - Carbamic acid ester - 1,2,3-triazole - Oxacycle - Azacycle - Organoheterocyclic compound - Alcohol - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Primary alcohol - Organic nitrogen compound - Aromatic alcohol - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as fluorobenzenes. These are compounds containing one or more fluorine atoms attached to a benzene ring.
External Descriptors
Not available