Compound Identification
SMILES
O=C(NC1=CC=C(C=C1)C1=NC(NC2=CC=CC=C2)=NC=C1)C(NC1CCCCC1)C1=CC=CC=C1
InChIKey
InChIKey=HZHNISQRRCXMMT-UHFFFAOYSA-N
Formula
C30H31N5O
Mass
477.612
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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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
Alpha amino acid amides Phenylacetamides Anilides N-arylamides Aniline and substituted anilines Cyclohexylamines Aralkylamines Aminopyrimidines and derivatives Heteroaromatic compounds Secondary carboxylic acid amides Dialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid amide - 4-phenylpyrimidine - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Phenylacetamide - Anilide - N-arylamide - Aniline or substituted anilines - Aminopyrimidine - Cyclohexylamine - Aralkylamine - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Secondary aliphatic amine - Carboxylic acid derivative - Secondary amine - Azacycle - Organic oxygen compound - Organic oxide - Carbonyl group - Organic nitrogen compound - Amine - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Aromatic heteromonocyclic 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