Structure Information
Structure

Compound Identification

SMILES

CCN(CC1=CC2=C(OCCO2)C=C1)C(=S)NC1=C(Cl)C=CC(=C1)[N+]([O-])=O

InChIKey

InChIKey=ONALYDUARPCNQI-UHFFFAOYSA-N

Formula

C18H18ClN3O4S

Mass

407.87

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

N-phenylthioureas

Intermediate Tree Nodes

Not available

Direct Parent

N-phenylthioureas

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzo-1,4-dioxane - Benzodioxane - N-phenylthiourea - Nitrobenzene - Nitroaromatic compound - Alkyl aryl ether - Halobenzene - Chlorobenzene - Aryl chloride - Aryl halide - Para-dioxin - Organic nitro compound - C-nitro compound - Thiourea - Allyl-type 1,3-dipolar organic compound - Ether - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Organic oxoazanium - Oxacycle - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic zwitterion - Organic salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as n-phenylthioureas. These are compounds containing a N-phenylthiourea moiety, which is structurally characterized by a phenyl group linked to one nitrogen atom of a thiourea group.

External Descriptors

Not available

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