Structure Information
Structure

Compound Identification

SMILES

CC1(C)CC(C)(O)N(C(=S)N1)C1=C(N)C=CC(=C1)[N+]([O-])=O

InChIKey

InChIKey=UNGRJSDFBFUCRO-UHFFFAOYSA-N

Formula

C13H18N4O3S

Mass

310.37

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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 heteromonocyclic compounds

Substituents

N-phenylthiourea - Nitrobenzene - Nitroaromatic compound - Aniline or substituted anilines - 1,3-diazinane - C-nitro compound - Organic nitro compound - Thiourea - Azacycle - Alkanolamine - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Primary amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Amine - Organic zwitterion - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organic salt - Organic oxide - Aromatic heteromonocyclic 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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