Compound Identification
SMILES
CC1=NC=C2[C@H](CC[C@@H](N12)C1=CC=C(C=C1)C#N)N1CCN(C(=O)C1)C1=CC(Cl)=CC=C1
InChIKey
InChIKey=BSZUMEBFECGWKO-PKTZIBPZSA-N
Formula
C25H24ClN5O
Mass
445.95
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 Pyridinylpiperazines
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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
Pyridinylpiperazines
Alternative Parents
N-arylpiperazines Phenylpiperazines Alpha amino acids and derivatives Imidazopyridines Benzonitriles Aralkylamines N-alkylpiperazines Chlorobenzenes N-substituted imidazoles Aryl chlorides Pyridines and derivatives Tertiary carboxylic acid amides Heteroaromatic compounds Trialkylamines Lactams Nitriles Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylpiperazine - Pyridinylpiperazine - N-arylpiperazine - Alpha-amino acid or derivatives - Imidazopyridine - Benzonitrile - Halobenzene - Chlorobenzene - N-alkylpiperazine - Aralkylamine - Aryl halide - Aryl chloride - Monocyclic benzene moiety - Pyridine - Benzenoid - N-substituted imidazole - Tertiary carboxylic acid amide - Azole - Imidazole - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Lactam - Carboxylic acid derivative - Azacycle - Carbonitrile - Nitrile - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyridinylpiperazines. These are compounds containing a pyridinylpiperazine skeleton, which consists of a pyridine linked (not fused) to a piperazine by a bond by a single bond that is not part of a ring.
External Descriptors
Not available