Compound Identification
SMILES
O=C1OC2=C(C=CC(=C2)S(=O)(=O)NC2=NC=NS2)N1CC1=CC=CC=C1C1=CCNCC1
InChIKey
InChIKey=PFZZKCGLKKPXIK-UHFFFAOYSA-N
Formula
C21H19N5O4S2
Mass
469.53
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzoxazoles
- Subclass Benzoxazolones
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Class
Benzoxazoles
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxazoles
Subclass
Benzoxazolones
Intermediate Tree Nodes
Not available
Direct Parent
Benzoxazolones
Alternative Parents
Organosulfonamides Hydropyridines Benzene and substituted derivatives Thiadiazoles Oxazoles Heteroaromatic compounds Aminosulfonyl compounds Oxacyclic compounds Dialkylamines Azacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazolone - Monocyclic benzene moiety - Hydropyridine - Organosulfonic acid amide - Benzenoid - Azole - Oxazole - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Thiadiazole - Aminosulfonyl compound - Heteroaromatic compound - Secondary amine - Secondary aliphatic amine - Azacycle - Oxacycle - Amine - Organosulfur compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoxazolones. These are organic compounds containing a benzene fused to an oxazole ring (a five-member aliphatic ring with three carbon atoms, one oxygen atom, and one nitrogen atom) bearing a ketone group.
External Descriptors
Not available