Compound Identification
SMILES
CCOC(=O)C1=CNC2=NC=NC(=C12)C1=C(C)C(NC(=O)C=C)=CC=C1
InChIKey
InChIKey=ZEDVWMUPMKSMPT-UHFFFAOYSA-N
Formula
C19H18N4O3
Mass
350.378
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Diazines
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Subclass
Pyrimidines and pyrimidine derivatives
- Level 5 Phenylpyrimidines
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Subclass
Pyrimidines and pyrimidine derivatives
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Class
Diazines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazines
Subclass
Pyrimidines and pyrimidine derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrimidines
Alternative Parents
Pyrrolo[2,3-d]pyrimidines Anilides Pyrrole carboxylic acids and derivatives N-arylamides Toluenes Substituted pyrroles Vinylogous amides Heteroaromatic compounds Acrylic acids and derivatives Secondary carboxylic acid amides Carboxylic acid esters Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
4-phenylpyrimidine - Pyrrolopyrimidine - Anilide - Pyrrolo[2,3-d]pyrimidine - N-arylamide - Pyrrole-3-carboxylic acid or derivatives - Toluene - Benzenoid - Substituted pyrrole - Monocyclic benzene moiety - Acrylic acid or derivatives - Vinylogous amide - Pyrrole - Heteroaromatic compound - Carboxylic acid ester - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrimidines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrimidine ring through a CC or CN bond. 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