Structure Information
Structure

Compound Identification

SMILES

CC(=O)C1=C(C)NC(=S)N[C@H]1C1=CC=CC=C1F

InChIKey

InChIKey=YBQJDMALYRRALC-LBPRGKRZSA-N

Formula

C13H13FN2OS

Mass

264.32

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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

Pyrimidinethiones

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

2-thiopyrimidine - Thiopyrimidine - Fluorobenzene - Halobenzene - Pyrimidinethione - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Hydropyrimidine - Benzenoid - 1,2,3,4-tetrahydropyrimidine - Vinylogous amide - Thiourea - Ketone - Azacycle - Organofluoride - Organohalogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as pyrimidinethiones. These are compounds containing a pyrimidine ring that bears a thioketone. 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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