Compound Identification
SMILES
NC1=NC(=O)C2=C(N1)N(C=C2)[C@@H]1CO[C@H](COCC2=CC=CC=C2)C1
InChIKey
InChIKey=BMDGDZPRBLWCQQ-KBPBESRZSA-N
Formula
C18H20N4O3
Mass
340.383
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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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
Benzylethers Pyrimidones Aminopyrimidines and derivatives Substituted pyrroles Primary aromatic amines Vinylogous amides Oxolanes Heteroaromatic compounds Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzylether - Pyrrolo[2,3-d]pyrimidine - Aminopyrimidine - Pyrimidone - Monocyclic benzene moiety - Primary aromatic amine - Pyrimidine - Benzenoid - Substituted pyrrole - Oxolane - Heteroaromatic compound - Vinylogous amide - Pyrrole - Dialkyl ether - Ether - Oxacycle - Azacycle - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Amine - Organopnictogen compound - Primary amine - Hydrocarbon derivative - Organic oxygen compound - 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