Structure Information
Structure

Compound Identification

SMILES

O=C(CN1N=CC2=C(SC=C2)C1=O)NCCN1CCN(CC2=CC=CC=C2)CC1

InChIKey

InChIKey=MYJCQNZUNXNZLF-UHFFFAOYSA-N

Formula

C21H25N5O2S

Mass

411.52

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Phenylmethylamines

Intermediate Tree Nodes

Not available

Direct Parent

Phenylmethylamines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzylamine - Phenylmethylamine - Pyridazinone - N-alkylpiperazine - Aralkylamine - 1,4-diazinane - Piperazine - Pyridazine - Heteroaromatic compound - Thiophene - Carboxamide group - Lactam - Amino acid or derivatives - Secondary carboxylic acid amide - Tertiary amine - Tertiary aliphatic amine - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Amine - Organic nitrogen compound - Carbonyl group - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenylmethylamines. These are compounds containing a phenylmethtylamine moiety, which consists of a phenyl group substituted by an methanamine.

External Descriptors

Not available

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