Structure Information
Structure

Compound Identification

SMILES

O=C(CSC1=NNC(=O)N1C[C@H]1CCCO1)C(C#N)=C1NC2=CC=CC=C2N1

InChIKey

InChIKey=YDEYESFUHFETGZ-LLVKDONJSA-N

Formula

C18H18N6O3S

Mass

398.44

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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 - Aryl thioether - Alkylarylthioether - Benzenoid - Acryloyl-group - Azole - Enone - Heteroaromatic compound - Oxolane - Vinylogous amide - 1,2,4-triazole - Ketene acetal or derivatives - Ketone - Dialkyl ether - Ether - Oxacycle - Carbonitrile - Nitrile - Azacycle - Thioether - Sulfenyl compound - Hydrocarbon derivative - Amine - Organic oxygen compound - Cyanide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Organic nitrogen compound - Organic oxide - 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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