Compound Identification
SMILES
COC1=CC=C(CC(C)(C)NC[C@H](O)[C@H]2CSCN2CC2=CC=CC(=C2)C#N)C=C1
InChIKey
InChIKey=QBYIVQVEYGJHTK-PKTZIBPZSA-N
Formula
C24H31N3O2S
Mass
425.59
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Phenethylamines
- Level 5 Amphetamines and derivatives
-
Subclass
Phenethylamines
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenethylamines
Intermediate Tree Nodes
Not available
Direct Parent
Amphetamines and derivatives
Alternative Parents
Phenylpropanes Phenoxy compounds Methoxybenzenes Anisoles Benzonitriles Benzylamines Alkyl aryl ethers Aralkylamines Thiazolidines 1,2-aminoalcohols Secondary alcohols Thiohemiaminal derivatives Dialkylamines Azacyclic compounds Dialkylthioethers Nitriles Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Amphetamine or derivatives - Phenylpropane - Anisole - Benzonitrile - Benzylamine - Phenol ether - Phenoxy compound - Methoxybenzene - Aralkylamine - Alkyl aryl ether - Thiazolidine - 1,2-aminoalcohol - Secondary alcohol - Azacycle - Organoheterocyclic compound - Dialkylthioether - Hemithioaminal - Secondary aliphatic amine - Ether - Carbonitrile - Nitrile - Thioether - Secondary amine - Hydrocarbon derivative - Alcohol - Organonitrogen compound - Organooxygen compound - Amine - Organic nitrogen compound - Organic oxygen compound - Cyanide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as amphetamines and derivatives. These are organic compounds containing or derived from 1-phenylpropan-2-amine.
External Descriptors
Not available