Compound Identification
SMILES
CCOP(=S)(OCC)OC1=NC(=NC(COC)=C1C)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=SFCLKBXYGMSNGQ-UHFFFAOYSA-N
Formula
C17H22ClN2O4PS
Mass
416.86
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Organic thiophosphoric acids and derivatives
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Subclass
Thiophosphoric acid esters
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Level 5
Aryl thiophosphates
- Level 6 Pyrimidinyl phosphorothioates
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Level 5
Aryl thiophosphates
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Subclass
Thiophosphoric acid esters
-
Class
Organic thiophosphoric acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Organic thiophosphoric acids and derivatives
Subclass
Thiophosphoric acid esters
Intermediate Tree Nodes
Aryl thiophosphates
Direct Parent
Pyrimidinyl phosphorothioates
Alternative Parents
Thiophosphate triesters Chlorobenzenes Pyrimidines and pyrimidine derivatives Aryl chlorides Heteroaromatic compounds Dialkyl ethers Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyrimidinyl phosphorothioate - Thiophosphate triester - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Heteroaromatic compound - Dialkyl ether - Ether - Azacycle - Organoheterocyclic compound - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyrimidinyl phosphorothioates. These are organic compounds containing the thiophosphoric acid functional group or a derivative thereof, with the general structure ROP(OR')(OR'')=S, where R= pyrimidine, R' = organyl group , and R\" = any atom.
External Descriptors
Not available