Structure Information
Structure

Compound Identification

SMILES

CN(CCCNC(=O)CCCC1=CC=C(C=C1)N(CCCl)CCCl)CCCNC(=O)CCNC(=O)C1=CC(NC(=O)C2=NC(NC(=O)CCNC(=O)C3=CC(NC(=O)C4=NC(NC(C)=O)=CN4C)=CN3C)=CN2C)=CN1C

InChIKey

InChIKey=NABCQHFBLBVTCT-UHFFFAOYSA-N

Formula

C51H70Cl2N16O8

Mass

1106.13

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Peptidomimetics

Subclass

Imidazole-pyrrole oligo- and polyamides

Intermediate Tree Nodes

Not available

Direct Parent

Imidazole-pyrrole oligo- and polyamides

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Imidazole-pyrrole oligoamide fragment - Beta amino acid or derivatives - N-acetylarylamine - 1,2,4-trisubstituted-imidazole - 2-heteroaryl carboxamide - Nitrogen mustard - Pyrrole-2-carboxamide - Pyrrole-2-carboxylic acid or derivatives - Tertiary aliphatic/aromatic amine - Trisubstituted imidazole - N-arylamide - Dialkylarylamine - Aniline or substituted anilines - Imidolactam - Benzenoid - Monocyclic benzene moiety - N-acyl-amine - N-methylpyrrole - Substituted pyrrole - N-substituted imidazole - Fatty amide - Fatty acyl - Imidazole - Azole - Heteroaromatic compound - Pyrrole - Acetamide - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Amino acid or derivatives - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Organopnictogen compound - Organic nitrogen compound - Alkyl halide - Organohalogen compound - Organochloride - Alkyl chloride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as imidazole-pyrrole oligo- and polyamides. These are polycyclic aromatic peptidomimetics consisting of alternating pyrrole and imidazole rings connected by a carboxamide group to form a N-(1H-pyrrol-3-yl)-1H-imidazole-2-carboxamide moiety.

External Descriptors

Not available

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