Structure Information
Structure

Compound Identification

SMILES

CN1C2=C3[C@@H](S[C@@H](CN4CCOC4=O)CN3C(C3=NC(C)=CS3)=C2C(=O)N(C)C1=O)C1=CC=C(Cl)O1

InChIKey

InChIKey=YILZNBNKEXAKMX-BUXKBTBVSA-N

Formula

C23H22ClN5O5S2

Mass

548.03

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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

2,4-disubstituted 1,3-thiazole - Pyrimidone - Aryl chloride - Aryl halide - Oxazolidinone - Substituted pyrrole - Azole - Furan - Oxazolidine - Heteroaromatic compound - Pyrrole - Thiazole - Carbamic acid ester - Vinylogous amide - Urea - Lactam - Oxacycle - Thioether - Dialkylthioether - Azacycle - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Carbonyl group - 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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