Structure Information
Structure

Compound Identification

SMILES

CC(C)C1=C\C(=C2\NNC(=S)N2C2=CC=C(Br)C=C2)C(=O)C=C1O

InChIKey

InChIKey=KQOYVOYFDUUSFL-DTQAZKPQSA-N

Formula

C17H16BrN3O2S

Mass

406.3

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Monoterpenoids

Intermediate Tree Nodes

Not available

Direct Parent

Aromatic monoterpenoids

Alternative Parents

Monocyclic monoterpenoids O-quinomethanes Bromobenzenes Aryl bromides Vinylogous amides Vinylogous acids Triazolidines Ketene acetals Enols Azacyclic compounds Organosulfur compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Aromatic monoterpenoid - Monocyclic monoterpenoid - Quinomethane - O-quinomethane - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Vinylogous amide - Vinylogous acid - Triazolidine - Cyclic ketone - Ketene acetal or derivatives - Ketone - Azacycle - Enol - Organoheterocyclic compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organobromide - Organohalogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as aromatic monoterpenoids. These are monoterpenoids containing at least one aromatic ring.

External Descriptors

Not available

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