Compound Identification
SMILES
NS(=O)(=O)C1=C(Cl)C=C2C(=O)N(CCCN3CCN(CC3)C3=C(C=CC=N3)C#N)C(=O)C2=C1
InChIKey
InChIKey=LRHKNZAQBQVIDE-UHFFFAOYSA-N
Formula
C21H21ClN6O4S
Mass
488.95
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
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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 Phthalimides Isoindoles 3-pyridinecarbonitriles Dialkylarylamines Aminopyridines and derivatives N-alkylpiperazines Organosulfonamides N-substituted carboxylic acid imides Imidolactams Aryl chlorides Benzenoids Aminosulfonyl compounds Heteroaromatic compounds Trialkylamines Amino acids and derivatives Nitriles Azacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyridinylpiperazine - N-arylpiperazine - Phthalimide - Isoindolone - Isoindoline - Isoindole - Isoindole or derivatives - 3-pyridinecarbonitrile - Dialkylarylamine - Aminopyridine - N-alkylpiperazine - Carboxylic acid imide, n-substituted - Pyridine - Organosulfonic acid amide - Aryl halide - Imidolactam - Aryl chloride - Benzenoid - Carboxylic acid imide - Organic sulfonic acid or derivatives - Aminosulfonyl compound - Organosulfonic acid or derivatives - Heteroaromatic compound - Sulfonyl - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Nitrile - Carbonitrile - Azacycle - Carboxylic acid derivative - Organohalogen compound - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Amine - Hydrocarbon derivative - Organic oxide - Cyanide - Organochloride - Organonitrogen compound - Organooxygen 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