Compound Identification
SMILES
COC1=CC=CC(CNC[C@@H](O)[C@@H](CC2=CC(F)=CC(F)=C2)NC(=O)CC2=CC=C(SC)C=C2)=C1
InChIKey
InChIKey=SCCVOJLPXVZYIP-CLJLJLNGSA-N
Formula
C27H30F2N2O3S
Mass
500.6
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
Amphetamines and derivatives Phenylacetamides Thiophenol ethers Anisoles Benzylamines Methoxybenzenes Phenoxy compounds Phenylmethylamines Fluorobenzenes Alkylarylthioethers Aralkylamines Alkyl aryl ethers Aryl fluorides Amino acids and derivatives 1,2-aminoalcohols Secondary alcohols Secondary carboxylic acid amides Dialkylamines Sulfenyl compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organofluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenylbutylamine - Phenylacetamide - Amphetamine or derivatives - Benzylamine - Phenol ether - Phenylmethylamine - Thiophenol ether - Anisole - Phenoxy compound - Methoxybenzene - Aryl thioether - Halobenzene - Fluorobenzene - Alkylarylthioether - Aralkylamine - Alkyl aryl ether - Aryl fluoride - Aryl halide - Secondary carboxylic acid amide - 1,2-aminoalcohol - Carboxamide group - Secondary alcohol - Amino acid or derivatives - Sulfenyl compound - Thioether - Secondary amine - Carboxylic acid derivative - Secondary aliphatic amine - Ether - Organooxygen compound - Carbonyl group - Organosulfur compound - Organic oxygen compound - Alcohol - Organic nitrogen compound - Amine - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organofluoride - Organohalogen compound - Aromatic homomonocyclic 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