Compound Identification
SMILES
ClC1=CC=C(S1)C1=NC2=CC=CC=C2C(=C1)C(=O)OCC(=O)NC1CCCC1
InChIKey
InChIKey=UTYXSCJEKXGYBA-UHFFFAOYSA-N
Formula
C21H19ClN2O3S
Mass
414.9
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Quinolines and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Quinolines and derivatives
Alternative Parents
Pyridinecarboxylic acids 2,5-disubstituted thiophenes Benzenoids Aryl chlorides Heteroaromatic compounds Secondary carboxylic acid amides Carboxylic acid esters Azacyclic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinoline - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - 2,5-disubstituted thiophene - Aryl chloride - Aryl halide - Pyridine - Benzenoid - Thiophene - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Organic oxide - Organonitrogen compound - Organochloride - Organohalogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as quinolines and derivatives. These are compounds containing a quinoline moiety, which consists of a benzene ring fused to a pyrimidine ring to form benzo[b]azabenzene.
External Descriptors
Not available