Compound Identification
SMILES
CC(C)N1C(=O)NC2=C1C=C(C=C2)C1=NN=C(NC[C@H](N)CC2=CC=C(C=C2)C(F)(F)F)S1
InChIKey
InChIKey=LMTFSQXXKNJXDG-MRXNPFEDSA-N
Formula
C22H23F3N6OS
Mass
476.52
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Phenethylamines
- Level 5 Amphetamines and derivatives
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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
Trifluoromethylbenzenes Benzimidazoles Aralkylamines 2-amino-5-substituted-1,3,4-thiadiazoles N-substituted imidazoles Heteroaromatic compounds Ureas Azacyclic compounds Organooxygen compounds Organofluorides Organic oxides Monoalkylamines Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Amphetamine or derivatives - Trifluoromethylbenzene - Benzimidazole - 2-amino-5-substituted-1,3,4-thiadiazole - Aralkylamine - 2-amino-1,3,4-thiadiazole - N-substituted imidazole - Azole - Heteroaromatic compound - Imidazole - Thiadiazole - Urea - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl halide - Primary aliphatic amine - Alkyl fluoride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Amine - Organooxygen compound - Primary amine - Aromatic heteropolycyclic 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