Structure Information
Structure

Compound Identification

SMILES

CC1=C(C(N2C(=O)C(SC2=N1)=CC1=CC=C(O1)C1=CC(Br)=CC=C1)C1=CC=C(F)C=C1)C(=O)NC1=CC=CC=C1

InChIKey

InChIKey=MKHPSABDFDNQTE-UHFFFAOYSA-N

Formula

C31H21BrFN3O3S

Mass

614.49

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazines

Subclass

Pyrimidines and pyrimidine derivatives

Intermediate Tree Nodes

Pyrimidinecarboxylic acids and derivatives

Direct Parent

Pyrimidinecarboxamides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Anilide - Pyrimidinecarboxamide - N-arylamide - Bromobenzene - Fluorobenzene - Halobenzene - Aryl bromide - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - Thiazole - Furan - Carboxamide group - Secondary carboxylic acid amide - Isothiourea - Lactam - Azacycle - Carboxylic acid derivative - Oxacycle - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organobromide - Organofluoride - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyrimidinecarboxamides. These are compounds containing a pyrimidine ring which bears a carboxamide.

External Descriptors

Not available

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