Structure Information
Structure

Compound Identification

SMILES

C(CNC1=NN=C(NSC2=NC=CC=N2)S1)COC1=CC=CC(CN2CCCCC2)=C1

InChIKey

InChIKey=ZYEMRUQHOZPHBD-UHFFFAOYSA-N

Formula

C21H27N7OS2

Mass

457.62

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Piperidines

Subclass

Benzylpiperidines

Intermediate Tree Nodes

Not available

Direct Parent

N-benzylpiperidines

Alternative Parents

Phenylmethylamines Phenoxy compounds Phenol ethers Benzylamines Aralkylamines Alkyl aryl ethers 2-amino-5-substituted-1,3,4-thiadiazoles Pyrimidines and pyrimidine derivatives Heteroaromatic compounds Trialkylamines Sulfenyl compounds Organosulfenic acid amides Azacyclic compounds Hydrocarbon derivatives

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

N-benzylpiperidine - Phenoxy compound - Benzylamine - Phenol ether - Phenylmethylamine - Alkyl aryl ether - 2-amino-5-substituted-1,3,4-thiadiazole - Aralkylamine - 2-amino-1,3,4-thiadiazole - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Thiadiazole - Azole - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Azacycle - Ether - Sulfenyl compound - Organosulfenic acid amide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Amine - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as n-benzylpiperidines. These are heterocyclic Compounds containing a piperidine ring conjugated to a benzyl group through one nitrogen ring atom.

External Descriptors

Not available

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