Structure Information
Structure

Compound Identification

SMILES

CNC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@H](CC1=CC=CC=C1)NC(=O)O[C@H]1CO[C@H]2OCC[C@@H]12

InChIKey

InChIKey=KWIBJGUCBSHWJI-HHJUPYMQSA-N

Formula

C29H38N4O7S2

Mass

618.76

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Phenylbutylamines

Intermediate Tree Nodes

Not available

Direct Parent

Phenylbutylamines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phenylbutylamine - Amphetamine or derivatives - 1,3-benzothiazole - Furofuran - Secondary aliphatic/aromatic amine - Organosulfonic acid amide - 1,3-thiazol-2-amine - Organic sulfonic acid or derivatives - Heteroaromatic compound - Oxolane - Aminosulfonyl compound - Carbamic acid ester - Thiazole - Sulfonyl - Azole - Organosulfonic acid or derivatives - Secondary alcohol - Acetal - Oxacycle - Azacycle - Organoheterocyclic compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Hydrocarbon derivative - Alcohol - Organic nitrogen compound - 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

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