Compound Identification
SMILES
ClC1=C(OC2CCN(CC2)C(=O)C2CCCC2)C=CC(NC2=NC=NC3=CN=C(NC4CC4)C=C23)=C1
InChIKey
InChIKey=QZQVSFLUXIWVTR-UHFFFAOYSA-N
Formula
C27H31ClN6O2
Mass
507.04
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyridopyrimidines
- Subclass Pyrido[3,4-d]pyrimidines
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Class
Pyridopyrimidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridopyrimidines
Subclass
Pyrido[3,4-d]pyrimidines
Intermediate Tree Nodes
Not available
Direct Parent
Pyrido[3,4-d]pyrimidines
Alternative Parents
N-acylpiperidines Phenoxy compounds Phenol ethers Aniline and substituted anilines Alkyl aryl ethers Aminopyridines and derivatives Aminopyrimidines and derivatives Chlorobenzenes Imidolactams Aryl chlorides Tertiary carboxylic acid amides Heteroaromatic compounds Azacyclic compounds Amines Hydrocarbon derivatives Organic oxides Organochlorides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrido[3,4-d]pyrimidine - N-acyl-piperidine - Phenoxy compound - Aniline or substituted anilines - Phenol ether - Alkyl aryl ether - Aminopyridine - Aminopyrimidine - Chlorobenzene - Halobenzene - Aryl chloride - Monocyclic benzene moiety - Aryl halide - Imidolactam - Piperidine - Pyridine - Benzenoid - Pyrimidine - Tertiary carboxylic acid amide - Heteroaromatic compound - Carboxamide group - Azacycle - Carboxylic acid derivative - Ether - Organic nitrogen compound - Organohalogen compound - Organochloride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrido[3,4-d]pyrimidines. These are compounds containing the pyrido[3,4-d]pyrimidine ring system, which is a pyridopyrimidine isomer with three ring nitrogen atoms at the 1-, 3-, and 7- position.
External Descriptors
Not available