Structure Information
Structure

Compound Identification

SMILES

COC(=O)NC1=NC2=C(N1)C=C(C=C2)S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@H](CC1=CC=CC=C1)NC(=O)C1=C(C)C=C(N)C=C1

InChIKey

InChIKey=YTCNVIAEWQZTQD-WUFINQPMSA-N

Formula

C31H38N6O6S

Mass

622.74

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzimidazoles

Subclass

2-benzimidazolylcarbamic acid esters

Intermediate Tree Nodes

Not available

Direct Parent

2-benzimidazolylcarbamic acid esters

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2-benzimidazolylcarbamic acid ester - Phenylbutylamine - Aminobenzamide - Aminobenzoic acid or derivatives - Amphetamine or derivatives - O-toluamide - Toluamide - Benzamide - Benzoic acid or derivatives - Benzoyl - Aniline or substituted anilines - Aminotoluene - Toluene - Benzenoid - Monocyclic benzene moiety - Organosulfonic acid amide - Aminosulfonyl compound - Azole - Carbamic acid ester - Heteroaromatic compound - Imidazole - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Secondary carboxylic acid amide - Secondary alcohol - Amino acid or derivatives - Carboxamide group - Azacycle - Carboxylic acid derivative - Amine - Carbonyl group - Alcohol - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Primary amine - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 2-benzimidazolylcarbamic acid esters. These are aromatic heteropolycyclic compounds that contain a carbamic acid ester group, which is N-linked to the C2-atom of a benzimidazole moiety.

External Descriptors

Not available

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