Compound Identification
SMILES
Cl.O=C1C=CC=C\C1=C1/NC2=C(CNS(=O)(=O)N2)C(=C1)C1CCCNC1
InChIKey
InChIKey=YQQCPCHJCAEUAR-JRUHLWALSA-N
Formula
C17H21ClN4O3S
Mass
396.89
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Cyclic ketones
-
Level 7
Quinomethanes
- Level 8 O-quinomethanes
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Level 7
Quinomethanes
-
Level 6
Cyclic ketones
-
Level 5
Ketones
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
Ketones - Cyclic ketones - Quinomethanes
Direct Parent
O-quinomethanes
Alternative Parents
Dihydropyridines Sulfuric acid diamides Piperidines Vinylogous amides Ketene acetals Enamines Dialkylamines Azacyclic compounds Organic oxides Hydrochlorides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
O-quinomethane - Dihydropyridine - Sulfuric acid diamide - Piperidine - Organic sulfuric acid or derivatives - Vinylogous amide - Ketene acetal or derivatives - Secondary aliphatic amine - Enamine - Azacycle - Organoheterocyclic compound - Secondary amine - Hydrocarbon derivative - Organic oxide - Hydrochloride - Organonitrogen compound - Organic nitrogen compound - Amine - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as o-quinomethanes. These are organic compounds containing a benzene ring conjugated to a methylidene group and a ketone at carbon atoms 1 and 2, respectively.
External Descriptors
Not available