Structure Information
Structure

Compound Identification

SMILES

FC1=C(F)C=C(CN2CC3=C(C=C(S3)C(=O)NCC3=CN=CC=C3)N=C2)C=C1

InChIKey

InChIKey=HGEYGZJCFTYSDF-UHFFFAOYSA-N

Formula

C20H16F2N4OS

Mass

398.43

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Thienopyrimidines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Thienopyrimidines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Pyrimidinecarboxamide - Thienopyrimidine - 2-heteroaryl carboxamide - Thiophene carboxamide - Benzylamine - Thiophene carboxylic acid or derivatives - 2,3,5-trisubstituted thiophene - Fluorobenzene - Halobenzene - Aryl fluoride - Pyrimidine - Aryl halide - Monocyclic benzene moiety - Pyridine - Benzenoid - Thiophene - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Amidine - Formamidine - Carboxylic acid amidine - Carboxylic acid derivative - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organic oxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as thienopyrimidines. These are heterocyclic compounds containing a thiophene ring fused to a pyrimidine ring. Thiophene is 5-membered ring consisting of four carbon atoms and one sulfur atom. 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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