Compound Identification
SMILES
CC(C)C1=C(SC2=CC(Cl)=CC(Cl)=C2)N(CC2=CC=NC=C2)C(COC(=O)NCP(O)(O)=O)=N1
InChIKey
InChIKey=CRQVLSZBDNGTIC-UHFFFAOYSA-N
Formula
C21H23Cl2N4O5PS
Mass
545.37
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organosulfur compounds
-
Class
Thioethers
-
Subclass
Aryl thioethers
- Level 5 Diarylthioethers
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Subclass
Aryl thioethers
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Class
Thioethers
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Superclass
Organosulfur compounds
Kingdom
Organic compounds
Superclass
Organosulfur compounds
Class
Thioethers
Subclass
Aryl thioethers
Intermediate Tree Nodes
Not available
Direct Parent
Diarylthioethers
Alternative Parents
1,2,4,5-tetrasubstituted imidazoles Thiophenol ethers Dichlorobenzenes Pyridines and derivatives Aryl chlorides N-substituted imidazoles Organic phosphonic acids Carbamate esters Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides Organonitrogen compounds Organophosphorus compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Diarylthioether - 1,2,4,5-tetrasubstituted imidazole - 1,3-dichlorobenzene - Thiophenol ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - N-substituted imidazole - Pyridine - Heteroaromatic compound - Azole - Imidazole - Organophosphonic acid - Organophosphonic acid derivative - Carbamic acid ester - Azacycle - Sulfenyl compound - Organoheterocyclic compound - Organohalogen compound - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Organooxygen compound - Organophosphorus compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as diarylthioethers. These are organosulfur compounds containing a thioether group that is substituted by two aryl groups.
External Descriptors
Not available