Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(CSCCNC(=O)CN(CCSCC2=CC=C(OC)C=C2)C[C@@H]2[C@H]3CC[C@@H](C[C@@H]2C2=CC=C(Cl)C=C2)N3C)C=C1

InChIKey

InChIKey=DGPZQMOUTSIMFE-NRTZDQBCSA-N

Formula

C37H48ClN3O3S2

Mass

682.38

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

Tropane alkaloids

Subclass

Phenyltropanes

Intermediate Tree Nodes

Not available

Direct Parent

Phenyltropanes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phenyltropane - Alpha-amino acid amide - Phenylpiperidine - Alpha-amino acid or derivatives - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Chlorobenzene - Aralkylamine - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - N-alkylpyrrolidine - Piperidine - Pyrrolidine - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Sulfenyl compound - Dialkylthioether - Thioether - Organoheterocyclic compound - Ether - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organohalogen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenyltropanes. These are compounds containing a phenyl group linked to a tropane moiety. Tropane is an organonitrogenous [3.2.1] bicyclic organic compound.

External Descriptors

Not available

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