Structure Information
Structure

Compound Identification

SMILES

COC([O-])=C1[C@H](C2=CC=CC=C2[N+]([O-])=O)C2=C(NC(=S)NC2=O)N=C1C

InChIKey

InChIKey=UZBNQSHAIGUCIT-NSHDSACASA-M

Formula

C16H13N4O5S

Mass

373.36

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyridopyrimidines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Pyridopyrimidines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Pyridopyrimidine - Nitrobenzene - Nitroaromatic compound - 2-thiopyrimidine - Thiopyrimidine - Pyrimidinethione - Pyrimidone - Monocyclic benzene moiety - Pyridine - Pyrimidine - Benzenoid - Heteroaromatic compound - Vinylogous amide - Ketene acetal or derivatives - Thiourea - Organic nitro compound - Ketimine - Lactam - C-nitro compound - Azacycle - Organic oxoazanium - Organic salt - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organosulfur compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Imine - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyridopyrimidines. These are compounds containing a pyridopyrimidine, which consists of a pyridine fused to a pyrimidine. Pyridine is 6-membered ring consisting of five carbon atoms and a nitrogen 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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