Compound Identification
SMILES
OCC1=CC=CC(=C1)C1=NC(=NC(=N1)N1CCN(CC1)C(=O)CCl)C1=CC=NC=C1
InChIKey
InChIKey=BSAYQQGQUQTDMI-UHFFFAOYSA-N
Formula
C21H21ClN6O2
Mass
424.89
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
Dialkylarylamines Benzyl alcohols Aminotriazines Pyridines and derivatives 1,3,5-triazines Tertiary carboxylic acid amides Heteroaromatic compounds Chloroacetamides Amino acids and derivatives Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Aromatic alcohols Organic oxides Organochlorides Alkyl chlorides Primary alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-arylpiperazine - Benzyl alcohol - Dialkylarylamine - Amino-1,3,5-triazine - Aminotriazine - Monocyclic benzene moiety - Pyridine - Triazine - Benzenoid - 1,3,5-triazine - Heteroaromatic compound - Tertiary carboxylic acid amide - Chloroacetamide - Amino acid or derivatives - Tertiary amine - Carboxamide group - Azacycle - Carboxylic acid derivative - Organic oxide - Organonitrogen compound - Organochloride - Organohalogen compound - Organooxygen compound - Primary alcohol - Carbonyl group - Alkyl chloride - Alcohol - Organic oxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Alkyl halide - Aromatic alcohol - 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