Structure Information
Structure

Compound Identification

SMILES

NC(CC(N)=O)CC1=CC=C(CCCCN=C(N)NC(=O)C2=C(N)N=C(N)C(Cl)=N2)C=C1

InChIKey

InChIKey=MOENGRSDDQEFEF-UHFFFAOYSA-N

Formula

C20H28ClN9O2

Mass

461.96

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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 heteromonocyclic compounds

Substituents

Beta amino acid or derivatives - Phenylbutylamine - Amphetamine or derivatives - Pyrazine carboxylic acid or derivatives - Pyrazinecarboxamide - Aminopyrazine - Aralkylamine - Aryl chloride - Aryl halide - Fatty amide - Fatty acyl - Imidolactam - Pyrazine - Heteroaromatic compound - Vinylogous amide - Amino acid or derivatives - Carboxamide group - Guanidine - Primary carboxylic acid amide - Carboximidamide - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Azacycle - Primary amine - Primary aliphatic amine - Organic nitrogen compound - Organohalogen compound - Organochloride - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic 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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