Compound Identification
SMILES
COC1=C(C)C=C(CN2C[C@@H](C)[C@@H](C2)C2=NC(=O)C3=CNN(C4CCCC4)C3=N2)C=C1
InChIKey
InChIKey=JDFLPTJZQXNZQI-OXQOHEQNSA-N
Formula
C24H31N5O2
Mass
421.545
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyrazolopyrimidines
- Subclass Pyrazolo[3,4-d]pyrimidines
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Class
Pyrazolopyrimidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrazolopyrimidines
Subclass
Pyrazolo[3,4-d]pyrimidines
Intermediate Tree Nodes
Not available
Direct Parent
Pyrazolo[3,4-d]pyrimidines
Alternative Parents
Anisoles Phenylmethylamines Phenoxy compounds Benzylamines Methoxybenzenes Alkyl aryl ethers Toluenes Pyrimidones Aralkylamines N-alkylpyrrolidines Heteroaromatic compounds Pyrazoles Vinylogous amides Trialkylamines Azacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrazolo[3,4-d]pyrimidine - Phenoxy compound - Anisole - Phenol ether - Phenylmethylamine - Benzylamine - Methoxybenzene - Alkyl aryl ether - Aralkylamine - Pyrimidone - Toluene - Monocyclic benzene moiety - Pyrimidine - Benzenoid - N-alkylpyrrolidine - Azole - Heteroaromatic compound - Pyrrolidine - Vinylogous amide - Pyrazole - Tertiary aliphatic amine - Tertiary amine - Azacycle - Ether - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrazolo[3,4-d]pyrimidines. These are aromatic heterocyclic compounds containing a pyrazolo[3,4-d]pyrimidine ring system, which consists of a pyrazole ring fused to but and not sharing a nitrogen atom with a pyrimidine ring.
External Descriptors
Not available