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Structure Information
Structure

Compound Identification

SMILES

CC1C(=O)NC2=C1C=C(C=C2)C1=CN=C(NC[C@@H](N)CC2=CC=C(C=C2)C(F)(F)F)S1

InChIKey

InChIKey=LQVQTIBGYOCLJB-INSVYWFGSA-N

Formula

C22H21F3N4OS

Mass

446.49

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Phenethylamines

Intermediate Tree Nodes

Not available

Direct Parent

Amphetamines and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Trifluoromethylbenzene - Amphetamine or derivatives - Dihydroindole - Indole or derivatives - 2,5-disubstituted 1,3-thiazole - Aralkylamine - 1,3-thiazol-2-amine - Azole - Thiazole - Heteroaromatic compound - Amino acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Lactam - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Organic nitrogen compound - Primary aliphatic amine - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Primary amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Alkyl halide - Alkyl fluoride - 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

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