Structure Information
Structure

Compound Identification

SMILES

CC(C)CN(C[C@@H](O)[C@H](CC1=CC=CC=C1)NC(=O)OCC1=CN=CS1)S(=O)(=O)C1=CC2=C(C=C1)N=C(NC(=O)C1CCCN(C)C1)S2

InChIKey

InChIKey=JVKYRLWPJTWKCO-RENJQWLISA-N

Formula

C33H42N6O6S3

Mass

714.92

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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 - 3-piperidinecarboxamide - Piperidinecarboxamide - N-arylamide - Piperidine - Organosulfonic acid amide - Azole - Heteroaromatic compound - Aminosulfonyl compound - Carbamic acid ester - Organic sulfonic acid or derivatives - Thiazole - Organosulfonic acid or derivatives - Sulfonyl - Amino acid or derivatives - Carboxamide group - Carbonic acid derivative - Secondary alcohol - Secondary carboxylic acid amide - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Alcohol - Amine - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen 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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