Compound Identification
SMILES
[Cl-].OC(CC[NH+]1CC2CCC(CC2)C1)(CC1=CC=CC=C1)C1=CC=CS1
InChIKey
InChIKey=ADQQWPNWZYNRTO-UHFFFAOYSA-N
Formula
C22H30ClNOS
Mass
392.0
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
Azepanes Aralkylamines Thiophenes Tertiary alcohols Heteroaromatic compounds 1,3-aminoalcohols Trialkylamines Azacyclic compounds Organopnictogen compounds Organic zwitterions Organic chloride salts Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylbutylamine - Azepane - Aralkylamine - 1,3-aminoalcohol - Tertiary alcohol - Heteroaromatic compound - Thiophene - Tertiary amine - Tertiary aliphatic amine - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Aromatic alcohol - Organic zwitterion - Organic salt - Organic chloride salt - Hydrocarbon derivative - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Amine - Alcohol - Aromatic heteropolycyclic 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