Compound Identification
SMILES
[Cl-].[Cl-].[Cl-].O=C([C@@H]1CSC([NH2+]1)C1=C[NH+]=CC=C1)N1CC[NH+](CCCCC2=CC=CC=C2)CC1
InChIKey
InChIKey=UWGJPTHAVSHOST-FRXHHECKSA-N
Formula
C23H33Cl3N4OS
Mass
519.95
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
Alpha amino acids and derivatives Aralkylamines N-alkylpiperazines Pyridinium derivatives Thiazolidines Tertiary carboxylic acid amides Quaternary ammonium salts Heteroaromatic compounds Trialkylamines Azacyclic compounds Dialkylthioethers Organic oxides Carbonyl compounds Organic zwitterions Organic chloride salts Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylbutylamine - Alpha-amino acid or derivatives - Aralkylamine - N-alkylpiperazine - 1,4-diazinane - Piperazine - Pyridine - Pyridinium - Heteroaromatic compound - Quaternary ammonium salt - Tertiary carboxylic acid amide - Thiazolidine - Amino acid or derivatives - Carboxamide group - Tertiary amine - Tertiary aliphatic amine - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Dialkylthioether - Thioether - Organic chloride salt - Amine - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Organic salt - Organic zwitterion - Carbonyl group - 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