Structure Information
Structure

Compound Identification

SMILES

NC(=S)C(=N\NC1=C(N=CN1)[N+]([O-])=O)\C#N

InChIKey

InChIKey=YHXVAGSRKWIBIR-QDEBKDIKSA-N

Formula

C6H5N7O2S

Mass

239.21

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Imidazoles

Intermediate Tree Nodes

Substituted imidazoles

Direct Parent

Nitroimidazoles

Alternative Parents

Nitroaromatic compounds Imidolactams Thioamides Heteroaromatic compounds Thiocarboxylic acid amides Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Nitriles Hydrazones Azacyclic compounds Thiocarbonyl compounds Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Nitroaromatic compound - Nitroimidazole - Imidolactam - Thioamide - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Hydrazone - Carbonitrile - Nitrile - Organic oxoazanium - Thiocarboxylic acid amide - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Azacycle - Thiocarbonyl group - Cyanide - Organic nitrogen compound - Organic zwitterion - Organic oxygen compound - Organonitrogen compound - Organic salt - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as nitroimidazoles. These are compounds containing an imidazole ring which bears a nitro group.

External Descriptors

Not available

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