Structure Information
Structure

Compound Identification

SMILES

OC(=O)C(F)(F)F.CSC1=C(C=C(S1)C(N)=N)S(=O)(=O)C1=CC(Br)=C2N=CN(CC3=C(F)C=CC(N)=C3)C2=C1

InChIKey

InChIKey=AQOQAPIYEXBBEF-UHFFFAOYSA-N

Formula

C22H18BrF4N5O4S3

Mass

668.49

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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

Not available

Substituents

Benzimidazole - Aryl thioether - Aniline or substituted anilines - 2,3,5-trisubstituted thiophene - Halobenzene - Fluorobenzene - Alkylarylthioether - N-substituted imidazole - Aryl bromide - Aryl fluoride - Aryl halide - Benzenoid - Monocyclic benzene moiety - Thiophene - Azole - Sulfonyl - Sulfone - Heteroaromatic compound - Alpha-halocarboxylic acid or derivatives - Imidazole - Alpha-halocarboxylic acid - Amidine - Azacycle - Sulfenyl compound - Carboximidamide - Thioether - Carboxylic acid amidine - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Amine - Carbonyl group - Alkyl fluoride - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Organic oxide - Primary amine - Organosulfur compound - Organooxygen compound - Hydrocarbon derivative - Organonitrogen compound - Organohalogen compound - Organobromide - Organofluoride - 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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