Compound Identification
SMILES
CC1=CC=C(NCCC2=CN=C3NC(N)=NC(=O)C3=N2)C=C1
InChIKey
InChIKey=FVLGVUXGUJDQEX-UHFFFAOYSA-N
Formula
C15H16N6O
Mass
296.334
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pteridines and derivatives
- Subclass Pterins and derivatives
-
Class
Pteridines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pteridines and derivatives
Subclass
Pterins and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pterins and derivatives
Alternative Parents
Phenylalkylamines Aniline and substituted anilines Aminotoluenes Secondary alkylarylamines Pyrimidones Aminopyrimidines and derivatives Pyrazines Vinylogous amides Heteroaromatic compounds Azacyclic compounds Primary amines Organopnictogen compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pterin - Aniline or substituted anilines - Phenylalkylamine - Aminotoluene - Aminopyrimidine - Pyrimidone - Secondary aliphatic/aromatic amine - Toluene - Aralkylamine - Pyrazine - Pyrimidine - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Vinylogous amide - Azacycle - Secondary amine - Amine - Hydrocarbon derivative - Organic nitrogen compound - Primary amine - Organooxygen compound - Organopnictogen compound - Organic oxide - Organonitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pterins and derivatives. These are polycyclic aromatic compounds containing a pterin moiety, which consist of a pteridine ring bearing a ketone and an amine group to form 2-aminopteridin-4(3H)-one.
External Descriptors
Not available