Compound Identification
SMILES
CN1C=NC=C1C(OCC1=C(C=C(C#N)C(=N1)N1CCN(CC1)C(C)=O)C1=CC(Cl)=CC=C1)C1=CC=C(C=C1)C#N
InChIKey
InChIKey=NSUUDAUUQPVPAO-UHFFFAOYSA-N
Formula
C31H28ClN7O2
Mass
566.06
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
Phenylpyridines N-arylpiperazines Benzylethers 3-pyridinecarbonitriles Benzonitriles Dialkylarylamines Aminopyridines and derivatives Chlorobenzenes Aryl chlorides N-substituted imidazoles Imidolactams Acetamides Tertiary carboxylic acid amides Heteroaromatic compounds Amino acids and derivatives Dialkyl ethers Nitriles Azacyclic compounds Carbonyl compounds Organic oxides Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyridinylpiperazine - 3-phenylpyridine - N-arylpiperazine - Benzylether - Dialkylarylamine - Benzonitrile - 3-pyridinecarbonitrile - Aminopyridine - Chlorobenzene - Halobenzene - Pyridine - Imidolactam - Benzenoid - Aryl chloride - Monocyclic benzene moiety - Aryl halide - N-substituted imidazole - Azole - Imidazole - Heteroaromatic compound - Acetamide - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Tertiary amine - Nitrile - Carbonitrile - Dialkyl ether - Azacycle - Ether - Carboxylic acid derivative - Amine - Organohalogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Organic nitrogen compound - 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