Compound Identification
SMILES
O=C1N=C2N(C3=CC=CC=C3)C3=CC=CC=C3N=C2C(=O)N1CCCNCC#C
InChIKey
InChIKey=UUVHAWSCLIMOCA-UHFFFAOYSA-N
Formula
C22H19N5O2
Mass
385.427
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pteridines and derivatives
- Subclass Alloxazines and isoalloxazines
-
Class
Pteridines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pteridines and derivatives
Subclass
Alloxazines and isoalloxazines
Intermediate Tree Nodes
Not available
Direct Parent
Alloxazines and isoalloxazines
Alternative Parents
Quinoxalines Pyrimidones Pyrazines Benzene and substituted derivatives Vinylogous amides Heteroaromatic compounds Lactams Dialkylamines Azacyclic compounds Acetylides Organopnictogen compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoalloxazine - Diazanaphthalene - Quinoxaline - Pyrimidone - Benzenoid - Pyrimidine - Pyrazine - Monocyclic benzene moiety - Heteroaromatic compound - Vinylogous amide - Lactam - Acetylide - Azacycle - Secondary amine - Secondary aliphatic amine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alloxazines and isoalloxazines. These are organic compounds comprising the (iso)alloxazine structure (Benzo[g]pteridine-2,4-dione).
External Descriptors
Not available