Structure Information
Structure

Compound Identification

SMILES

O=C1NC(=S)NC2=C1CP(=S)(CC2)C1=CC=CC=C1

InChIKey

InChIKey=OQFCRBFTPIOOJB-UHFFFAOYSA-N

Formula

C13H13N2OPS2

Mass

308.35

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazines

Subclass

Pyrimidines and pyrimidine derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Pyrimidones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2-thiopyrimidine - Pyrimidinethione - Thiopyrimidine - Pyrimidone - Monocyclic benzene moiety - Benzenoid - Vinylogous amide - Heteroaromatic compound - Thiourea - Lactam - Azacycle - Phosphine sulfide - Organothiophosphorus compound - Phosphacycle - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organosulfur compound - Organophosphorus compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyrimidones. These are compounds that contain a pyrimidine ring, which bears a ketone. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.

External Descriptors

Not available

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