Compound Identification
SMILES
CC1=NN(CC(=O)N2CCN(CC2)C2=CC=CC=C2C2=CN=C(N=C2)N2CCCC(C2)C(N)=O)C(C)=C1
InChIKey
InChIKey=SBZRYOJXQYHQNM-UHFFFAOYSA-N
Formula
C27H34N8O2
Mass
502.623
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
Phenylpiperazines N-arylpiperazines Piperidinecarboxamides Dialkylarylamines Aniline and substituted anilines Aminopyrimidines and derivatives Tertiary carboxylic acid amides Pyrazoles Heteroaromatic compounds Primary carboxylic acid amides Amino acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylpiperazine - 5-phenylpyrimidine - N-arylpiperazine - 3-piperidinecarboxamide - Piperidinecarboxamide - Dialkylarylamine - Aniline or substituted anilines - Aminopyrimidine - Benzenoid - Piperidine - Piperazine - Monocyclic benzene moiety - 1,4-diazinane - Heteroaromatic compound - Tertiary carboxylic acid amide - Pyrazole - Azole - Tertiary amine - Primary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Azacycle - Carboxylic acid derivative - Amine - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Organic oxide - 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