Compound Identification
SMILES
O=C1NC2=CN=C(NC[C@H]3CCNC3)N=C2N1CC1=CC2=CC=CC=C2C=C1
InChIKey
InChIKey=HCDHUMBBNSEGEZ-HNNXBMFYSA-N
Formula
C21H22N6O
Mass
374.448
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Imidazopyrimidines
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Subclass
Purines and purine derivatives
- Level 5 Purinones
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Subclass
Purines and purine derivatives
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Class
Imidazopyrimidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Imidazopyrimidines
Subclass
Purines and purine derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Purinones
Alternative Parents
Naphthalenes Secondary alkylarylamines Aminopyrimidines and derivatives N-substituted imidazoles Pyrrolidines Heteroaromatic compounds Ureas Dialkylamines Azacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Naphthalene - Purinone - Aminopyrimidine - Secondary aliphatic/aromatic amine - N-substituted imidazole - Pyrimidine - Benzenoid - Pyrrolidine - Imidazole - Azole - Heteroaromatic compound - Urea - Secondary amine - Secondary aliphatic amine - Azacycle - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as purinones. These are purines in which the purine moiety bears a C=O group. Purine is a bicyclic aromatic compound made up of a pyrimidine ring fused to an imidazole ring.
External Descriptors
Not available