Compound Identification
SMILES
COC(=O)C1=CC=CC=C1NC1=NC(=CC(NC2=NNC(C)=C2)=N1)N1CCN(CC1)S(=O)(=O)C(F)(F)F
InChIKey
InChIKey=KKXAJDHKOCIPJL-UHFFFAOYSA-N
Formula
C21H23F3N8O4S
Mass
540.52
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Diazinanes
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Subclass
Piperazines
- Level 5 N-arylpiperazines
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Subclass
Piperazines
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Class
Diazinanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazinanes
Subclass
Piperazines
Intermediate Tree Nodes
Not available
Direct Parent
N-arylpiperazines
Alternative Parents
Benzoic acid esters Aniline and substituted anilines Benzoyl derivatives Dialkylarylamines Aminopyrimidines and derivatives Organosulfonamides Imidolactams Organic sulfonamides Methyl esters Vinylogous amides Heteroaromatic compounds Pyrazoles Sulfonyls Trihalomethanes Azacyclic compounds Organic oxides Hydrocarbon derivatives Alkyl fluorides Organofluorides Organooxygen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-arylpiperazine - Benzoate ester - Benzoic acid or derivatives - Benzoyl - Aniline or substituted anilines - Dialkylarylamine - Aminopyrimidine - Monocyclic benzene moiety - Pyrimidine - Organic sulfonic acid amide - Organosulfonic acid amide - Imidolactam - Benzenoid - Azole - Pyrazole - Organic sulfonic acid or derivatives - Heteroaromatic compound - Organosulfonic acid or derivatives - Sulfonyl - Vinylogous amide - Methyl ester - Trihalomethane - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Organic oxide - Organofluoride - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Halomethane - Organosulfur compound - Hydrocarbon derivative - Amine - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-arylpiperazines. These are organic compounds containing a piperazine ring where the nitrogen ring atom carries an aryl group.
External Descriptors
Not available