Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC=C1N1C(SCC(=O)NC(C)(C#N)C(C)C)=NC2=C1C=CC(=C2)[N+]([O-])=O

InChIKey

InChIKey=QCDWODWWWODGBV-UHFFFAOYSA-N

Formula

C22H23N5O4S

Mass

453.52

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzimidazoles

Subclass

Phenylbenzimidazoles

Intermediate Tree Nodes

Not available

Direct Parent

Phenylbenzimidazoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phenylbenzimidazole - 1-phenylimidazole - Methoxyaniline - Phenol ether - Phenoxy compound - Methoxybenzene - Aryl thioether - Anisole - Nitroaromatic compound - Alkyl aryl ether - Alkylarylthioether - Benzenoid - N-substituted imidazole - Monocyclic benzene moiety - Imidazole - Heteroaromatic compound - Azole - C-nitro compound - Organic nitro compound - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Ether - Azacycle - Carbonitrile - Nitrile - Organic 1,3-dipolar compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Sulfenyl compound - Thioether - Cyanide - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Organic zwitterion - Organic salt - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenylbenzimidazoles. These are compounds containing a phenylbenzimidazole skeleton, which consists of a benzimidazole moiety where its imidazole ring is attached to a phenyl group.

External Descriptors

Not available

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