Compound Identification
SMILES
CC1=NN(C2=C1C=C(S2)C(=O)N1CCN(CC1)C1=CC=CC=N1)C1=CC=C(Br)C=C1
InChIKey
InChIKey=ATGGFGJRXGZXSV-UHFFFAOYSA-N
Formula
C22H20BrN5OS
Mass
482.4
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 Phenylpyrazoles Thiophene carboxamides 2,3,5-trisubstituted thiophenes 2-heteroaryl carboxamides Dialkylarylamines Aminopyridines and derivatives Bromobenzenes Imidolactams Aryl bromides Tertiary carboxylic acid amides Heteroaromatic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organobromides Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyridinylpiperazine - N-arylpiperazine - Phenylpyrazole - 2-heteroaryl carboxamide - Thiophene carboxamide - Dialkylarylamine - Thiophene carboxylic acid or derivatives - 2,3,5-trisubstituted thiophene - Aminopyridine - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Pyridine - Imidolactam - Benzenoid - Azole - Pyrazole - Thiophene - Tertiary carboxylic acid amide - Heteroaromatic compound - Carboxamide group - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organobromide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Amine - Organic nitrogen compound - Organic oxide - 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