Compound Identification
SMILES
CN(C)CC1=C(C=CC2=C1ON=C2CCC1CCNCC1)C1=CC=CS1
InChIKey
InChIKey=JBXYBXJLRZHUAA-UHFFFAOYSA-N
Formula
C21H27N3OS
Mass
369.53
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzisoxazoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzisoxazoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzisoxazoles
Alternative Parents
Aralkylamines Piperidines Benzenoids Thiophenes Isoxazoles Heteroaromatic compounds Trialkylamines Oxacyclic compounds Dialkylamines Azacyclic compounds Organooxygen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzisoxazole - Aralkylamine - Piperidine - Benzenoid - Azole - Isoxazole - Heteroaromatic compound - Thiophene - Tertiary amine - Tertiary aliphatic amine - Secondary amine - Oxacycle - Secondary aliphatic amine - Azacycle - Amine - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzisoxazoles. These are aromatic compounds containing a benzene ring fused to an isoxazole ring. Isoxazole is five-membered ring with three carbon atoms, and an oxygen atom next to a nitrogen atom.
External Descriptors
Not available