Compound Identification
SMILES
CN1C(N2C(OC(OC2=C(C1=O)C(C)(C)C)=C(C#N)C(C)(C)C)=C(C#N)C(C)(C)C)C1=CC=CC=C1
InChIKey
InChIKey=JICHQKQBHZDPFS-UHFFFAOYSA-N
Formula
C29H36N4O3
Mass
488.632
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazines
-
Subclass
Pyrimidines and pyrimidine derivatives
- Level 5 Hydropyrimidines
-
Subclass
Pyrimidines and pyrimidine derivatives
-
Class
Diazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazines
Subclass
Pyrimidines and pyrimidine derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Hydropyrimidines
Alternative Parents
Benzene and substituted derivatives Vinylogous esters Vinylogous amides Tertiary carboxylic acid amides Lactams Ketene acetals Oxacyclic compounds Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Monocyclic benzene moiety - Hydropyrimidine - 1,2,3,4-tetrahydropyrimidine - Benzenoid - Tertiary carboxylic acid amide - Vinylogous ester - Vinylogous amide - Carboxamide group - Ketene acetal or derivatives - Lactam - Carboxylic acid derivative - Oxacycle - Carbonitrile - Nitrile - Azacycle - Hydrocarbon derivative - Organic oxide - Cyanide - Amine - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as hydropyrimidines. These are compounds containing a hydrogenated pyrimidine ring (i.e. containing less than the maximum number of double bonds.).
External Descriptors
Not available