Structure Information
Structure

Compound Identification

SMILES

NC(NC(=O)C1=C(N)N=C(N)C(Cl)=N1)=NCCCCC1=CC=C(OCC(=O)N2CCNCC2)C=C1

InChIKey

InChIKey=OCJGAMGUWUGYRM-UHFFFAOYSA-N

Formula

C22H30ClN9O3

Mass

503.99

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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

Phenylbutylamine - Pyrazine carboxylic acid or derivatives - Pyrazinecarboxamide - Phenoxy compound - Phenol ether - Alkyl aryl ether - Aminopyrazine - Aryl chloride - Aryl halide - 1,4-diazinane - Piperazine - Pyrazine - Imidolactam - Tertiary carboxylic acid amide - Heteroaromatic compound - Vinylogous amide - Carboxamide group - Amino acid or derivatives - Guanidine - Secondary amine - Organoheterocyclic compound - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Carboxylic acid derivative - Secondary aliphatic amine - Ether - Primary amine - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Amine - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen 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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