Structure Information
Structure

Compound Identification

SMILES

CC1=C(NC(=S)NC2=CC=C(C=C2)[N+]([O-])=O)C=C2C(SC(C)(C)CC2(C)C)=C1

InChIKey

InChIKey=MJSONANZUBKYJB-UHFFFAOYSA-N

Formula

C21H25N3O2S2

Mass

415.57

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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

N-phenylthiourea - Thiochromane - Nitrobenzene - 1-benzothiopyran - Benzothiopyran - Aryl thioether - Nitroaromatic compound - Alkylarylthioether - Thiopyran - C-nitro compound - Thiourea - Organic nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Thioether - Organoheterocyclic compound - Organic nitrogen compound - Organic oxygen compound - Organic salt - Organosulfur compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic cation - 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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