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)COC1=C(C)C=C(C=C1)[N+]([O-])=O

InChIKey

InChIKey=YJMXBGAUUIICJR-WUFINQPMSA-N

Formula

C32H38N6O9S

Mass

682.75

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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 - Nitrophenyl ether - Phenylbutylamine - Amphetamine or derivatives - Nitrobenzene - Nitrotoluene - Phenoxy compound - Nitroaromatic compound - Phenol ether - Alkyl aryl ether - Toluene - Monocyclic benzene moiety - Organosulfonic acid amide - Benzenoid - Azole - Imidazole - Aminosulfonyl compound - Carbamic acid ester - Sulfonyl - Heteroaromatic compound - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Organic nitro compound - Carboxamide group - C-nitro compound - Secondary carboxylic acid amide - Secondary alcohol - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Ether - Azacycle - Organic oxoazanium - Alcohol - Organic zwitterion - Organic salt - Organic oxygen compound - Organic oxide - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic nitrogen 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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