Compound Identification
SMILES
O[C@]1(NC(S)=C(C#N)[C@@H]([C@H]1[N+]1=CC=CC2=C1C=CC(Cl)=C2)C1=CC=C(F)C=C1)C1=CC=CC=C1
InChIKey
InChIKey=SURHRMXIRQVTFB-ZWEKWIFMSA-O
Formula
C27H20ClFN3OS
Mass
488.98
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Quinolines and derivatives
-
Subclass
Haloquinolines
- Level 5 Chloroquinolines
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Subclass
Haloquinolines
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Class
Quinolines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Quinolines and derivatives
Subclass
Haloquinolines
Intermediate Tree Nodes
Not available
Direct Parent
Chloroquinolines
Alternative Parents
Tetrahydropyridines Fluorobenzenes Pyridinium derivatives Aryl fluorides Aryl chlorides Heteroaromatic compounds Ketene acetals Nitriles Azacyclic compounds Alkylthiols Alkanolamines Organofluorides Organochlorides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Chloroquinoline - Halobenzene - Fluorobenzene - Tetrahydropyridine - Benzenoid - Aryl halide - Pyridinium - Pyridine - Monocyclic benzene moiety - Hydropyridine - Aryl fluoride - Aryl chloride - Heteroaromatic compound - Ketene acetal or derivatives - Azacycle - Alkanolamine - Carbonitrile - Nitrile - Alkylthiol - Organic nitrogen compound - Organic oxygen compound - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Cyanide - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as chloroquinolines. These are compounds containing a quinoline moiety, which carries one or more chlorine atoms.
External Descriptors
Not available