Compound Identification
SMILES
OC(=O)C1=CC(NCCCC2=CC=C(OCC3=CC=CC=C3)C=C2)=CS1
InChIKey
InChIKey=OOOFITHBGFGNJR-UHFFFAOYSA-N
Formula
C21H21NO3S
Mass
367.46
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylpropylamines
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylpropylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpropylamines
Alternative Parents
Thiophene carboxylic acids Phenoxy compounds Phenol ethers Secondary alkylarylamines Aralkylamines Alkyl aryl ethers Aminothiophenes Heteroaromatic compounds Amino acids Carboxylic acids Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylpropylamine - Phenoxy compound - Phenol ether - Thiophene carboxylic acid or derivatives - Thiophene carboxylic acid - Alkyl aryl ether - Aralkylamine - Secondary aliphatic/aromatic amine - Aminothiophene - Heteroaromatic compound - Thiophene - Amino acid or derivatives - Amino acid - Carboxylic acid derivative - Carboxylic acid - Ether - Organoheterocyclic compound - Secondary amine - Organic oxygen compound - Amine - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpropylamines. These are compounds containing a phenylpropylamine moiety, which consists of a phenyl group substituted at the third carbon by an propan-1-amine.
External Descriptors
Not available