Compound Identification
SMILES
CCN1C=CC2=C1C=C(NC(=O)C1=CN=C(C=C1)N1CCN(CC1)C1=C(Cl)C=C(C=C1)C(O)=O)C=C2
InChIKey
InChIKey=JXNPFWRPRKTPRW-UHFFFAOYSA-N
Formula
C27H26ClN5O3
Mass
503.99
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
Phenylpiperazines N-arylpiperazines Halobenzoic acids 3-halobenzoic acids Aminobenzoic acids N-alkylindoles Benzoic acids Indoles Nicotinamides Benzoyl derivatives Aniline and substituted anilines Dialkylarylamines Chlorobenzenes Aminopyridines and derivatives Imidolactams Aryl chlorides Substituted pyrroles Heteroaromatic compounds Secondary carboxylic acid amides Amino acids Azacyclic compounds Carboxylic acids Hydrocarbon derivatives Organic oxides Organochlorides Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylpiperazine - Pyridinylpiperazine - N-arylpiperazine - N-alkylindole - Aminobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Aminobenzoic acid - Halobenzoic acid - 3-halobenzoic acid - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Benzoic acid - Indole - Indole or derivatives - Nicotinamide - Pyridine carboxylic acid or derivatives - Benzoyl - Aniline or substituted anilines - Dialkylarylamine - Aminopyridine - Chlorobenzene - Halobenzene - Benzenoid - Substituted pyrrole - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Imidolactam - Pyridine - Heteroaromatic compound - Pyrrole - Amino acid or derivatives - Amino acid - Carboxamide group - Secondary carboxylic acid amide - Tertiary amine - Azacycle - Carboxylic acid - Carboxylic acid derivative - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Amine - Organic oxygen 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