Compound Identification
SMILES
COCCN1C(Cl)=NC2=C(N(CC#CC)C(=N2)N2CCN(CC2)C(=O)OC(C)(C)C)C1=O
InChIKey
InChIKey=UXICPTZWRYBEDH-UHFFFAOYSA-N
Formula
C21H29ClN6O4
Mass
464.95
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
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
6-oxopurines Hypoxanthines Piperazine carboxylic acids Dialkylarylamines Pyrimidones 2-halopyrimidines N-substituted imidazoles Aminoimidazoles Aryl chlorides Carbamate esters Heteroaromatic compounds Lactams Azacyclic compounds Dialkyl ethers Carbonyl compounds Organochlorides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-arylpiperazine - 6-oxopurine - Hypoxanthine - Imidazopyrimidine - Piperazine-1-carboxylic acid - Purine - Dialkylarylamine - 2-halopyrimidine - Halopyrimidine - Pyrimidone - N-substituted imidazole - Aminoimidazole - Aryl chloride - Aryl halide - Pyrimidine - Imidazole - Heteroaromatic compound - Azole - Carbamic acid ester - Lactam - Azacycle - Dialkyl ether - Ether - Organooxygen compound - Organic oxygen compound - Amine - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteropolycyclic 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