Compound Identification
SMILES
COC1=CC=CC(CN2N=C(C)C3=C(N=C(C)N4N=C(C=C34)C3=CC=CC=C3)C2=O)=C1
InChIKey
InChIKey=DMBDPWSLQQLBSM-UHFFFAOYSA-N
Formula
C24H21N5O2
Mass
411.465
Taxonomic Classification
Taxonomy Tree
- Kingdom Organic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrazolo[1',5':1,6]pyrimido[4,5-d]pyridazines
Subclass
Pyrazolo[1',5':1,6]pyrimido[4,5-d]pyridazin-4-ones
Intermediate Tree Nodes
Not available
Direct Parent
Pyrazolo[1',5':1,6]pyrimido[4,5-d]pyridazin-4-ones
Alternative Parents
Phenylpyrazoles Pyrazolopyrimidines Phenoxy compounds Methoxybenzenes Anisoles Pyridazinones Alkyl aryl ethers Pyrimidines and pyrimidine derivatives Heteroaromatic compounds Lactams Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrazolo[1',5':1,6]pyrimido[4,5-d]pyridazin-4-one - Phenylpyrazole - Pyrazolopyrimidine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Pyridazinone - Monocyclic benzene moiety - Pyridazine - Benzenoid - Pyrimidine - Azole - Pyrazole - Heteroaromatic compound - Lactam - Ether - Azacycle - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organic nitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrazolo[1',5':1,6]pyrimido[4,5-d]pyridazin-4-ones. These are aromatic heterocyclic compounds containing a pyrimidine fused to both a pyrazole and a pyridazine rings. The resulting ring system carries an oxo group at the 4-position. Here, the pyrimidine ring shares one atom with the pyrazole ring, and no nitrogen atom with the pyrazole ring.
External Descriptors
Not available