Compound Identification
SMILES
COC(=O)C1=C(NC2=NC(=CC(NC3=NNC(C)=C3)=N2)N2CCN(C)CC2)C=CC=C1Cl
InChIKey
InChIKey=WXWAZLYZJGVLMN-UHFFFAOYSA-N
Formula
C21H25ClN8O2
Mass
456.94
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
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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 2-halobenzoic acids and derivatives Benzoyl derivatives Dialkylarylamines Aniline and substituted anilines Chlorobenzenes N-methylpiperazines Aminopyrimidines and derivatives Imidolactams Aryl chlorides Methyl esters Pyrazoles Heteroaromatic compounds Vinylogous amides Vinylogous halides Trialkylamines Amino acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organooxygen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-arylpiperazine - Benzoate ester - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Benzoyl - Aniline or substituted anilines - Dialkylarylamine - Aminopyrimidine - Chlorobenzene - Halobenzene - N-methylpiperazine - N-alkylpiperazine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyrimidine - Imidolactam - Benzenoid - Methyl ester - Pyrazole - Vinylogous halide - Vinylogous amide - Azole - Heteroaromatic compound - Tertiary amine - Amino acid or derivatives - Tertiary aliphatic amine - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Amine - Hydrocarbon derivative - Organooxygen 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