Compound Identification
SMILES
COC1=CC=C(NC2=NC3=NN(C(N)=C3C(=O)N2C2=CC=C(OC)C=C2)C2=CC=CC=C2)C=C1
InChIKey
InChIKey=KINFRXOARUFPAW-UHFFFAOYSA-N
Formula
C25H22N6O3
Mass
454.49
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Azoles
-
Subclass
Pyrazoles
- Level 5 Phenylpyrazoles
-
Subclass
Pyrazoles
-
Class
Azoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Pyrazoles
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrazoles
Alternative Parents
Methoxyanilines Pyrazolo[3,4-d]pyrimidines Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Aminopyrimidines and derivatives Pyrimidones Vinylogous amides Heteroaromatic compounds Lactams Azacyclic compounds Secondary amines Organic oxides Hydrocarbon derivatives Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylpyrazole - Pyrazolopyrimidine - Methoxyaniline - Pyrazolo[3,4-d]pyrimidine - Phenoxy compound - Aniline or substituted anilines - Methoxybenzene - Phenol ether - Anisole - Aminopyrimidine - Pyrimidone - Alkyl aryl ether - Pyrimidine - Monocyclic benzene moiety - Benzenoid - Vinylogous amide - Heteroaromatic compound - Lactam - Secondary amine - Azacycle - Ether - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Primary amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrazoles. These are compounds containing a phenylpyrazole skeleton, which consists of a pyrazole bound to a phenyl group.
External Descriptors
Not available