Compound Identification
SMILES
CC(C)(C)CN1C(CN2CCC(=O)CC2)=CC2=CN=C(N=C12)C#N
InChIKey
InChIKey=SYHBEDCSCPDPHK-UHFFFAOYSA-N
Formula
C18H23N5O
Mass
325.416
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Pyrrolopyrimidines
- Subclass Pyrrolo[2,3-d]pyrimidines
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Class
Pyrrolopyrimidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolopyrimidines
Subclass
Pyrrolo[2,3-d]pyrimidines
Intermediate Tree Nodes
Not available
Direct Parent
Pyrrolo[2,3-d]pyrimidines
Alternative Parents
Piperidinones Aralkylamines Substituted pyrroles Pyrimidines and pyrimidine derivatives Heteroaromatic compounds Trialkylamines Cyclic ketones Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrrolo[2,3-d]pyrimidine - Piperidinone - Aralkylamine - Piperidine - Pyrimidine - Substituted pyrrole - Pyrrole - Heteroaromatic compound - Cyclic ketone - Tertiary aliphatic amine - Tertiary amine - Ketone - Azacycle - Carbonitrile - Nitrile - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Cyanide - Amine - Organic oxide - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrrolo[2,3-d]pyrimidines. These are aromatic heteropolycyclic compounds containing a pyrrolo[2,3-d]pyrimidine ring system, which is an pyrrolopyrimidine isomers having the 3 ring nitrogen atoms at the 1-, 5-, and 7-positions.
External Descriptors
Not available