Compound Identification
SMILES
CCC1=NC2=CC=CC=C2C(C(=O)OCC(=O)NC2=C(C#N)C3=C(CCCCC3)S2)=C1C
InChIKey
InChIKey=FGDHOIVGVIWCML-UHFFFAOYSA-N
Formula
C25H25N3O3S
Mass
447.55
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
Cycloheptathiophenes Pyridinecarboxylic acids N-arylamides Methylpyridines Benzenoids Thiophenes Heteroaromatic compounds Secondary carboxylic acid amides Carboxylic acid esters Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cycloheptathiophene - Quinoline - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - N-arylamide - Methylpyridine - Pyridine - Benzenoid - Thiophene - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxylic acid ester - Carboxamide group - Nitrile - Carbonitrile - Carboxylic acid derivative - Azacycle - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - 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