Structure Information
Structure

Compound Identification

SMILES

CC1(C)OCCN2C(=O)C(OCC3=CC=CC=C3)=C(N=C12)C(=O)NCC1=CC=CC2=C1SC=C2

InChIKey

InChIKey=XMSBNVWJPREHHJ-UHFFFAOYSA-N

Formula

C26H25N3O4S

Mass

475.56

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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

Pyrimidinecarboxylic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzothiophene - 1-benzothiophene - Pyrimidine-6-carboxylic acid or derivatives - 2-heteroaryl carboxamide - Alkyl aryl ether - Pyrimidone - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Thiophene - Secondary carboxylic acid amide - Lactam - Carboxamide group - Ether - Dialkyl ether - Carboxylic acid derivative - Oxacycle - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyrimidinecarboxylic acids and derivatives. These are compounds containing a pyrimidine ring which bears a carboxylic acid group (or a derivative thereof).

External Descriptors

Not available

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