Structure Information
Structure

Compound Identification

SMILES

OC(=O)C(F)(F)F.CN(C)CC(=O)NC1=NC2=C(OC3=NC=NC(=C3)C3=CC=C(C=C3)C(F)(F)F)C=CC=C2S1

InChIKey

InChIKey=NIUYRVYPBARMPF-UHFFFAOYSA-N

Formula

C24H19F6N5O4S

Mass

587.5

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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

Phenylpyrimidines

Alternative Parents

Molecular Framework

Not available

Substituents

Alpha-amino acid amide - 4-phenylpyrimidine - Diaryl ether - Alpha-amino acid or derivatives - Trifluoromethylbenzene - 1,3-benzothiazole - N-arylamide - Phenol ether - Benzenoid - Monocyclic benzene moiety - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Heteroaromatic compound - Azole - Thiazole - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Carboxamide group - Secondary carboxylic acid amide - Monocarboxylic acid or derivatives - Azacycle - Carboxylic acid derivative - Carboxylic acid - Ether - Carbonyl group - Organic nitrogen compound - Alkyl halide - Organonitrogen compound - Alkyl fluoride - Amine - Hydrocarbon derivative - Organic oxygen compound - Organofluoride - Organohalogen compound - Organic oxide - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpyrimidines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrimidine ring through a CC or CN bond. 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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