Structure Information
Structure

Compound Identification

SMILES

COC1=C2NC3=C(SC2=NC=N1)C(=O)CC(C)(C)C3

InChIKey

InChIKey=YUYOLOMKDZYGDH-UHFFFAOYSA-N

Formula

C13H15N3O2S

Mass

277.34

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organosulfur compounds

Class

Thioethers

Subclass

Aryl thioethers

Intermediate Tree Nodes

Not available

Direct Parent

Aryl thioethers

Alternative Parents

Cyclohexenones Alkyl aryl ethers Pyrimidines and pyrimidine derivatives 1,4-thiazines Vinylogous amides Heteroaromatic compounds Thioenol ethers Enamines Azacyclic compounds Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Aryl thioether - Alkyl aryl ether - Cyclohexenone - Para-thiazine - Pyrimidine - Heteroaromatic compound - Vinylogous amide - Ketone - Thioenolether - Enamine - Ether - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Amine - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as aryl thioethers. These are organosulfur compounds containing a thioether group that is substituted by an aryl group.

External Descriptors

Not available

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