Compound Identification
SMILES
CCOC(=O)C1=C(N=C(N2CCN(CC2)C(=O)NS(=O)(=O)C2=CC=C(Cl)C=C2)C(=C1)C#N)C(F)(F)F
InChIKey
InChIKey=QPTUDBWQWSMCEA-UHFFFAOYSA-N
Formula
C21H19ClF3N5O5S
Mass
545.92
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazinanes
-
Subclass
Piperazines
- Level 5 Pyridinylpiperazines
-
Subclass
Piperazines
-
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
N-arylpiperazines Benzenesulfonamides Pyridinecarboxylic acids Piperazine carboxamides Benzenesulfonyl compounds 3-pyridinecarbonitriles Dialkylarylamines Sulfonylureas Aminopyridines and derivatives Chlorobenzenes Aryl chlorides Imidolactams Organosulfonic acids and derivatives Aminosulfonyl compounds Heteroaromatic compounds Carboxylic acid esters Nitriles Azacyclic compounds Carbonyl compounds Organic oxides Organochlorides Alkyl fluorides Hydrocarbon derivatives Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyridinylpiperazine - N-arylpiperazine - Benzenesulfonamide - Benzenesulfonyl group - Piperazine-1-carboxamide - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - 3-pyridinecarbonitrile - Dialkylarylamine - Aminopyridine - Chlorobenzene - Halobenzene - Sulfonylurea - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyridine - Imidolactam - Benzenoid - Aminosulfonyl compound - Heteroaromatic compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Carbonitrile - Nitrile - Organic nitrogen compound - Organohalogen compound - Organochloride - Organic oxide - Cyanide - Organofluoride - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Amine - Alkyl halide - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Alkyl fluoride - 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