Structure Information
Structure

Compound Identification

SMILES

CC1=NC(SCC(O)CCl)=C(N1)[N+]([O-])=O

InChIKey

InChIKey=ZWWUYKPJGJYICI-UHFFFAOYSA-N

Formula

C7H10ClN3O3S

Mass

251.69

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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

2,4,5-trisubstituted imidazoles Nitroaromatic compounds Alkylarylthioethers Heteroaromatic compounds Secondary alcohols Chlorohydrins Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organochlorides Alkyl chlorides Organonitrogen compounds

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

2,4,5-trisubstituted-imidazole - Nitroimidazole - Trisubstituted imidazole - Nitroaromatic compound - Aryl thioether - Alkylarylthioether - Heteroaromatic compound - Chlorohydrin - Halohydrin - Organic nitro compound - C-nitro compound - Secondary alcohol - Azacycle - Organic oxoazanium - Organic 1,3-dipolar compound - Thioether - Sulfenyl compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Alcohol - Organic salt - Alkyl halide - Organic oxygen compound - Alkyl chloride - Organic oxide - Organic zwitterion - Hydrocarbon derivative - Organic nitrogen 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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