Structure Information
Structure

Compound Identification

SMILES

C(C1=NCCN1)C1=CC=CC=C1.CCC1(C(=O)NC(=O)NC1=O)C1=CC=CC=C1.CN(CCC1=CC=CC=C1)CCC1=CC=CC=C1

InChIKey

InChIKey=GHFJRIHTLCCTOG-UHFFFAOYSA-N

Formula

C39H45N5O3

Mass

631.821

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazines

Subclass

Pyrimidines and pyrimidine derivatives

Intermediate Tree Nodes

Pyrimidones

Direct Parent

Barbituric acid derivatives

Alternative Parents

Molecular Framework

Not available

Substituents

Barbiturate - N-acyl urea - Ureide - Monocyclic benzene moiety - 1,3-diazinane - Imidolactam - Benzenoid - Dicarboximide - 2-imidazoline - Carbonic acid derivative - Urea - Amidine - Carboxylic acid amidine - Carboxylic acid derivative - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Organic oxide - Organopnictogen compound - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as barbituric acid derivatives. These are compounds containing a perhydropyrimidine ring substituted at C-2, -4 and -6 by oxo groups.

External Descriptors

Not available

Previous Back Next