Structure Information
Structure

Compound Identification

SMILES

CN1C=C([C@H]2N3C(S\C(=C/C4=CC(=CC=C4)[N+]([O-])=O)C3=O)=NC(C)=C2C(N)=O)C(C)=N1

InChIKey

InChIKey=YNXJDWDBMVAFLK-XYMPBJBSSA-N

Formula

C20H18N6O4S

Mass

438.46

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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

Nitrobenzene - Pyrimidinecarboxamide - Nitroaromatic compound - Monocyclic benzene moiety - Benzenoid - Azole - Pyrazole - Heteroaromatic compound - Thiazole - Carboxamide group - Isothiourea - Lactam - C-nitro compound - Primary carboxylic acid amide - Organic nitro compound - Azacycle - Organic oxoazanium - Carboxylic acid derivative - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organic zwitterion - Organic salt - 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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