Structure Information
Structure

Compound Identification

SMILES

CC(C)CN(CC(C)C)C(=O)C(C)(C)C1=CN=C2NC(=C([C@H](C)CNCCC3=CC=C(NS(C)(=O)=O)C=C3)C2=C1)C1=CC(C)=CC(C)=C1

InChIKey

InChIKey=KDGZNEWDKMRDLY-GDLZYMKVSA-N

Formula

C39H55N5O3S

Mass

673.96

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyrroles

Subclass

Substituted pyrroles

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpyrroles

Alternative Parents

Sulfanilides Pyrrolopyridines Phenethylamines m-Xylenes Aralkylamines Pyridines and derivatives Organosulfonamides Organic sulfonamides Tertiary carboxylic acid amides Aminosulfonyl compounds Heteroaromatic compounds Amino acids and derivatives Dialkylamines Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2-phenylpyrrole - Sulfanilide - Phenethylamine - Pyrrolopyridine - M-xylene - Xylene - Aralkylamine - Monocyclic benzene moiety - Pyridine - Benzenoid - Organic sulfonic acid amide - Organosulfonic acid amide - Heteroaromatic compound - Organic sulfonic acid or derivatives - Aminosulfonyl compound - Organosulfonic acid or derivatives - Tertiary carboxylic acid amide - Sulfonyl - Amino acid or derivatives - Carboxamide group - Secondary amine - Secondary aliphatic amine - Carboxylic acid derivative - Azacycle - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpyrroles. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrrole ring through a CC or CN bond.

External Descriptors

Not available

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