Compound Identification
SMILES
CC1=NC(C2CCN(CC2)C(=O)C2=C(Cl)C=CC(Cl)=N2)=C(C=C1)C(=O)N1CCSC1
InChIKey
InChIKey=IWCJQZPCIBMDHI-UHFFFAOYSA-N
Formula
C21H22Cl2N4O2S
Mass
465.39
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Pyridinecarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pyridinecarboxylic acids and derivatives
Alternative Parents
N-acylpiperidines Polyhalopyridines 2-heteroaryl carboxamides 2-halopyridines Methylpyridines Aryl chlorides Vinylogous halides Thiazolidines Tertiary carboxylic acid amides Heteroaromatic compounds Thiohemiaminal derivatives Azacyclic compounds Dialkylthioethers Organonitrogen compounds Organooxygen compounds Organochlorides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acyl-piperidine - Pyridine carboxylic acid or derivatives - 2-heteroaryl carboxamide - Polyhalopyridine - 2-halopyridine - Methylpyridine - Aryl chloride - Aryl halide - Piperidine - Heteroaromatic compound - Vinylogous halide - Thiazolidine - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Azacycle - Dialkylthioether - Hemithioaminal - Thioether - Organic nitrogen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyridinecarboxylic acids and derivatives. These are compounds containing a pyridine ring bearing a carboxylic acid group or a derivative thereof.
External Descriptors
Not available