Compound Identification
SMILES
ClC1=CC=CC=C1N1CCN(CC(=O)C(\C#N)=C2/NN=C3CCCCCN23)CC1
InChIKey
InChIKey=DTGUSFHXGYCQRW-LTGZKZEYSA-N
Formula
C21H25ClN6O
Mass
412.92
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazinanes
-
Subclass
Piperazines
- Level 5 Phenylpiperazines
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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
Phenylpiperazines
Alternative Parents
N-arylpiperazines Aniline and substituted anilines Dialkylarylamines Azepanes Chlorobenzenes N-alkylpiperazines Aryl chlorides Imidolactams Alpha-amino ketones Enones Triazolines Acryloyl compounds Vinylogous amides Ketene acetals Trialkylamines Amidrazones Hydrazones Azacyclic compounds Amidines Nitriles Hydrocarbon derivatives Organochlorides Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylpiperazine - N-arylpiperazine - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Halobenzene - Chlorobenzene - Azepane - N-alkylpiperazine - Imidolactam - Benzenoid - Aryl chloride - Monocyclic benzene moiety - Aryl halide - Vinylogous amide - Triazoline - Enone - Alpha-aminoketone - Acryloyl-group - Carboxylic acid amidrazone - Ketene acetal or derivatives - Ketone - Tertiary aliphatic amine - Tertiary amine - Carbonitrile - Nitrile - Azacycle - Amidine - Hydrazone - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Amine - Organic oxide - Cyanide - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpiperazines. These are compounds containing a phenylpiperazine skeleton, which consists of a piperazine bound to a phenyl group.
External Descriptors
Not available