Structure Information
Structure

Compound Identification

SMILES

OC(=O)C(F)(F)F.CC(C)c1cc(-c2n[nH]c(=O)n2-c2ccc(CN3CCC(CC3)C(=O)N3CCC(CNC(=O)CNC(=O)C[C@@H]4N=C(c5c(C)c(C)sc5-n5c(C)nnc45)c4ccc(Cl)cc4)CC3)cc2)c(O)cc1O

InChIKey

InChIKey=JPSIZRSIPISAPH-LMDYQTDMSA-N

Formula

C53H59ClF3N11O8S

Mass

1102.63

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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

Not available

Substituents

N-benzylpiperidine - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Aryl 1,2,4-triazol-3-one - Phenyl-1,2,4-triazole - Phenyltriazole - Thieno-para-diazepine - Alpha-amino acid or derivatives - N-substituted-alpha-amino acid - Piperidinecarboxamide - Phenylpropane - N-acyl-piperidine - Cumene - Resorcinol - Phenylmethylamine - Benzylamine - 1-hydroxy-2-unsubstituted benzenoid - Aralkylamine - Phenol - Halobenzene - Chlorobenzene - Para-diazepine - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Heteroaromatic compound - 1,2,4-triazole - Triazole - Thiophene - Tertiary carboxylic acid amide - Azole - Alpha-halocarboxylic acid or derivatives - Alpha-halocarboxylic acid - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Ketimine - Carboxamide group - Amino acid or derivatives - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organochloride - Organohalogen compound - Imine - Carbonyl group - Amine - Alkyl halide - Alkyl fluoride - Aromatic heteropolycyclic 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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