Structure Information
Structure

Compound Identification

SMILES

CCCCCCCCCCCCCCCC1=C(C2C(C(=O)OC)=C(C)NC(CN3C(=S)NC4=CC=CC=C34)=C2C(=O)OC)C(OC)=CC=C1

InChIKey

InChIKey=BMFWZQRHJJQBGI-UHFFFAOYSA-N

Formula

C40H55N3O5S

Mass

689.96

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzimidazoles

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzimidazoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzimidazole - Dihydropyridinecarboxylic acid derivative - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Dihydropyridine - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Hydropyridine - Imidazole-2-thione - N-substituted imidazole - Benzenoid - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Azole - Methyl ester - Imidazole - Heteroaromatic compound - Thiourea - Carboxylic acid ester - Azacycle - Ether - Enamine - Carboxylic acid derivative - Secondary aliphatic amine - Organosulfur compound - Amine - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzimidazoles. These are organic compounds containing a benzene ring fused to an imidazole ring (five member ring containing a nitrogen atom, 4 carbon atoms, and two double bonds).

External Descriptors

Not available

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