Compound Identification
SMILES
NC1=CC=C(SCC2COC(CCC3=CC=CC=C3)(CN3C=CN=C3)O2)C=C1
InChIKey
InChIKey=IZXIZCSYPUUAAG-UHFFFAOYSA-N
Formula
C22H25N3O2S
Mass
395.52
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylbutylamines
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylbutylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylbutylamines
Alternative Parents
Thiophenol ethers Aniline and substituted anilines Ketals Alkylarylthioethers Primary aromatic amines N-substituted imidazoles Heteroaromatic compounds 1,3-dioxolanes Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylbutylamine - Aryl thioether - Thiophenol ether - Aniline or substituted anilines - Ketal - Alkylarylthioether - N-substituted imidazole - Primary aromatic amine - Meta-dioxolane - Azole - Imidazole - Heteroaromatic compound - Sulfenyl compound - Thioether - Acetal - Organoheterocyclic compound - Oxacycle - Azacycle - Hydrocarbon derivative - Organopnictogen compound - Primary amine - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Amine - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylbutylamines. These are compounds containing a phenylbutylamine moiety, which consists of a phenyl group substituted at the fourth carbon by an butan-1-amine.
External Descriptors
Not available