Structure Information
Structure

Compound Identification

SMILES

CC[S@](=O)C1=C(N)C=CC(NC(=S)NC(=O)OC)=C1[N+]([O-])=O

InChIKey

InChIKey=YBSCPWDQNSYFMX-QFIPXVFZSA-N

Formula

C11H14N4O5S2

Mass

346.38

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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 homomonocyclic compounds

Substituents

N-phenylthiourea - Phenyl sulfoxide - Nitrobenzene - Nitroaromatic compound - Aniline or substituted anilines - Methylcarbamate - Carbamic acid ester - C-nitro compound - Sulfoxide - Organic nitro compound - Thiourea - Organic oxoazanium - Organic 1,3-dipolar compound - Sulfinyl compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic salt - Hydrocarbon derivative - Primary amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Amine - Organic oxide - Carbonyl group - Organic zwitterion - Organic nitrogen compound - Organic oxygen compound - Aromatic homomonocyclic 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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