Compound Identification
SMILES
CC(C)C[C@H]1CN(CCN1)C1=NC(C(=O)C2=CC(Br)=CN=C2N)=C(C=C1)C(F)(F)F
InChIKey
InChIKey=DXTVNZJVQABGJS-ZDUSSCGKSA-N
Formula
C20H23BrF3N5O
Mass
486.337
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
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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 Pyridinecarboxylic acids and derivatives Aryl ketones Dialkylarylamines Aminopyridines and derivatives Aryl bromides Imidolactams Vinylogous amides Heteroaromatic compounds Azacyclic compounds Dialkylamines Hydrocarbon derivatives Organic oxides Organobromides Organofluorides Primary amines Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyridinylpiperazine - N-arylpiperazine - Pyridine carboxylic acid or derivatives - Aryl ketone - Dialkylarylamine - Aminopyridine - Aryl bromide - Aryl halide - Pyridine - Imidolactam - Vinylogous amide - Heteroaromatic compound - Tertiary amine - Ketone - Azacycle - Secondary amine - Secondary aliphatic amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organobromide - Organohalogen compound - Primary amine - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Amine - Organic nitrogen compound - Organic oxide - Aromatic heteromonocyclic 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