Compound Identification
SMILES
CCC1=NC(=O)C2=C(N1)N=CN2CC1=CC=C(C=C1)C1=CC=CC=C1N1N=CN=N1
InChIKey
InChIKey=GDPPOEMXZJVFCS-UHFFFAOYSA-N
Formula
C21H18N8O
Mass
398.43
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Biphenyls and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Biphenyls and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Biphenyls and derivatives
Alternative Parents
Phenyltetrazoles and derivatives Hypoxanthines 6-oxopurines Pyrimidones N-substituted imidazoles Vinylogous amides Heteroaromatic compounds Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Biphenyl - Phenyltetrazole - 6-oxopurine - Hypoxanthine - Purinone - Imidazopyrimidine - Purine - Pyrimidone - Pyrimidine - N-substituted imidazole - Vinylogous amide - Tetrazole - Heteroaromatic compound - Azole - Imidazole - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as biphenyls and derivatives. These are organic compounds containing to benzene rings linked together by a C-C bond.
External Descriptors
Not available