Structure Information
Structure

Compound Identification

SMILES

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)N1CC[NH+](CC2=CSC=C2)CC1

InChIKey

InChIKey=PCBTYRXRYLOXTQ-UHFFFAOYSA-O

Formula

C21H28N3O3S

Mass

402.53

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Phenylcarbamic acid esters

Intermediate Tree Nodes

Not available

Direct Parent

Phenylcarbamic acid esters

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenylcarbamic acid ester - Benzamide - Benzoic acid or derivatives - Benzoyl - N-alkylpiperazine - Aralkylamine - 1,4-diazinane - Piperazine - Heteroaromatic compound - Quaternary ammonium salt - Tertiary carboxylic acid amide - Thiophene - Carbamic acid ester - Tertiary aliphatic amine - Carboxamide group - Tertiary amine - Amino acid or derivatives - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Amine - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenylcarbamic acid esters. These are ester derivatives of phenylcarbamic acids.

External Descriptors

Not available

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