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Structure Information
Structure

Compound Identification

SMILES

CC1=C(C=C(Cl)C=C1)N1C(SCC2=NC(=CS2)C(=O)NC2CCN(CC3=CC=CC=C3)CC2)=NN=C1C1=CN=CC=C1

InChIKey

InChIKey=NNOHUAAGXNPKNR-UHFFFAOYSA-N

Formula

C31H30ClN7OS2

Mass

616.2

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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

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

N-benzylpiperidine - Phenyltriazole - Phenyl-1,2,4-triazole - Pyridyltriazole - Pyridyl-1,2,4-triazole - Benzylamine - 2-heteroaryl carboxamide - Phenylmethylamine - Thiazolecarboxamide - Thiazolecarboxylic acid or derivatives - Aryl thioether - Aralkylamine - Alkylarylthioether - Toluene - 2,4-disubstituted 1,3-thiazole - Chlorobenzene - Halobenzene - Aryl halide - Benzenoid - Monocyclic benzene moiety - Aryl chloride - Pyridine - Heteroaromatic compound - 1,2,4-triazole - Triazole - Azole - Thiazole - Tertiary aliphatic amine - Carboxamide group - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Thioether - Sulfenyl compound - Organohalogen compound - Amine - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - 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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