Compound Identification
SMILES
NC(=S)C1(CC2=C(O)C(=CNC2C(F)=C1)C(=O)NCC1=CC=C(Cl)C=C1)C#CCO
InChIKey
InChIKey=VVSGMKADOJCCEH-UHFFFAOYSA-N
Formula
C21H19ClFN3O3S
Mass
447.91
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Quinolines and derivatives
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Subclass
Quinoline carboxamides
- Level 5 Quinoline-3-carboxamides
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Subclass
Quinoline carboxamides
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Class
Quinolines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Quinolines and derivatives
Subclass
Quinoline carboxamides
Intermediate Tree Nodes
Not available
Direct Parent
Quinoline-3-carboxamides
Alternative Parents
Hydroquinolines Chlorobenzenes Dihydropyridines Aryl chlorides Vinylogous amides Thioamides Secondary carboxylic acid amides Allylamines Fluoroalkenes Enols Enamines Dialkylamines Thiocarboxylic acid amides Azacyclic compounds Vinyl fluorides Organofluorides Organochlorides Organic oxides Hydrocarbon derivatives Thiocarbonyl compounds Carbonyl compounds Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinoline-3-carboxamide - Tetrahydroquinoline - Chlorobenzene - Dihydropyridine - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Vinylogous amide - Thioamide - Carboxamide group - Secondary carboxylic acid amide - Allylamine - Carboxylic acid derivative - Secondary aliphatic amine - Azacycle - Enamine - Enol - Fluoroalkene - Haloalkene - Vinyl halide - Vinyl fluoride - Thiocarboxylic acid amide - Alcohol - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary alcohol - Amine - Hydrocarbon derivative - Thiocarbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as quinoline-3-carboxamides. These are quinolines in which the quinoline ring system is substituted by one carboxamide group at the 3-position.
External Descriptors
Not available