Structure Information
Structure

Compound Identification

SMILES

OC(=O)C1=C(O)C(=O)N=C(N1)C1=C(NC(=O)CC2=CSC3=CC=CC=C23)C=CS1

InChIKey

InChIKey=YAVCDOHXIACIMS-UHFFFAOYSA-N

Formula

C19H13N3O5S2

Mass

427.45

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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

Pyrimidinecarboxylic acids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzothiophene - Hydropyrimidine carboxylic acid derivative - 1-benzothiophene - Pyrimidine-6-carboxylic acid - N-arylamide - Hydroxypyrimidine - Pyrimidone - Hydropyrimidine - Benzenoid - Heteroaromatic compound - Thiophene - Vinylogous amide - Vinylogous acid - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid - Carboxylic acid derivative - Azacycle - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyrimidinecarboxylic acids. These are pyrimidines with a structure containing a carboxyl group attached to the pyrimidine ring.

External Descriptors

Not available

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