Structure Information
Structure

Compound Identification

SMILES

CCN(CC)C1=CC=C(C=C1)C1C(C(=O)OC)=C(C)NC2=C1C(=O)N=C(N2)SCC1=CC=CC=C1F

InChIKey

InChIKey=ZVDPCBGMEXWERV-UHFFFAOYSA-N

Formula

C27H29FN4O3S

Mass

508.61

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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 - Aryl thioether - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Fluorobenzene - Halobenzene - Pyrimidone - Alkylarylthioether - Aryl fluoride - Benzenoid - Aryl halide - Monocyclic benzene moiety - Pyrimidine - Pyridine - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Heteroaromatic compound - Tertiary amine - Carboxylic acid ester - Amino acid or derivatives - Sulfenyl compound - Azacycle - Thioether - Carboxylic acid derivative - Enamine - Monocarboxylic acid or derivatives - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - 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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