Compound Identification
SMILES
CCOP(=O)(CC1=NC(N[C@H]2CC[C@@H](CC2)OC)=CC(Cl)=N1)OCC
InChIKey
InChIKey=RQODJOMMIZYVDP-JOCQHMNTSA-N
Formula
C16H27ClN3O4P
Mass
391.83
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazines
-
Subclass
Pyrimidines and pyrimidine derivatives
- Level 5 Halopyrimidines
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Subclass
Pyrimidines and pyrimidine derivatives
-
Class
Diazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazines
Subclass
Pyrimidines and pyrimidine derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Halopyrimidines
Alternative Parents
Dialkyl alkylphosphonates Aminopyrimidines and derivatives Phosphonic acid esters Imidolactams Aryl chlorides Heteroaromatic compounds Dialkyl ethers Azacyclic compounds Organophosphorus compounds Organochlorides Organic oxides Hydrocarbon derivatives Amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aminopyrimidine - Dialkyl alkylphosphonate - Halopyrimidine - Phosphonic acid diester - Aryl chloride - Aryl halide - Imidolactam - Phosphonic acid ester - Heteroaromatic compound - Organophosphonic acid derivative - Dialkyl ether - Ether - Azacycle - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen compound - Amine - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organophosphorus compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as halopyrimidines. These are aromatic compounds containing a halogen atom linked to a pyrimidine ring. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
External Descriptors
Not available