Compound Identification
SMILES
CCC1=C(CC(=O)C(N)=O)C2=C(N=C(SC)N=C2OCC(=O)OC)N1CC1=CC(F)=CC=C1
InChIKey
InChIKey=SYGRZIGTCFCFHQ-UHFFFAOYSA-N
Formula
C22H23FN4O5S
Mass
474.51
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
Alkyl aryl ethers Alkylarylthioethers Fluorobenzenes Substituted pyrroles Pyrimidines and pyrimidine derivatives Aryl fluorides Fatty amides Heteroaromatic compounds Methyl esters Ketones Primary carboxylic acid amides Sulfenyl compounds Azacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrrolo[2,3-d]pyrimidine - Aryl thioether - Alkyl aryl ether - Halobenzene - Fluorobenzene - Alkylarylthioether - Aryl fluoride - Aryl halide - Pyrimidine - Substituted pyrrole - Fatty amide - Benzenoid - Monocyclic benzene moiety - Fatty acyl - Methyl ester - Pyrrole - Heteroaromatic compound - Carboxylic acid ester - Primary carboxylic acid amide - Ketone - Carboxamide group - Azacycle - Carboxylic acid derivative - Sulfenyl compound - Ether - Thioether - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organohalogen compound - Organofluoride - 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