Compound Identification
SMILES
CC(C)C(NC(=O)CN1C(=O)C(NC(=O)OC(Cl)(Cl)Cl)=CN=C1C1=CC=C(F)C=C1)B1OC(C)(C)C(C)(C)O1
InChIKey
InChIKey=NEAYMOLNYSQVKY-UHFFFAOYSA-N
Formula
C24H29BCl3FN4O6
Mass
605.68
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Diazines
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Subclass
Pyrimidines and pyrimidine derivatives
- Level 5 Pyrimidones
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Subclass
Pyrimidines and pyrimidine derivatives
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Class
Diazines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazines
Subclass
Pyrimidines and pyrimidine derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pyrimidones
Alternative Parents
Fluorobenzenes Aryl fluorides Hydropyrimidines Boronic acid esters Carbamate esters Dioxaborolanes Heteroaromatic compounds Trihalomethanes Secondary carboxylic acid amides Lactams Oxacyclic compounds Azacyclic compounds Organic metalloid salts Hydrocarbon derivatives Monoalkylboranes Carbonyl compounds Organic oxides Organochlorides Organofluorides Organonitrogen compounds Alkyl chlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyrimidone - Halobenzene - Fluorobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Hydropyrimidine - Carbamic acid ester - Boronic acid ester - 1,3,2-dioxaborolane - Heteroaromatic compound - Boronic acid derivative - Trihalomethane - Carboxamide group - Secondary carboxylic acid amide - Lactam - Carboxylic acid derivative - Oxacycle - Azacycle - Organic metalloid salt - Organonitrogen compound - Organohalogen compound - Organooxygen compound - Organic nitrogen compound - Alkyl halide - Hydrocarbon derivative - Alkyl chloride - Halomethane - Carbonyl group - Organic oxide - Alkylborane - Monoalkylborane - Organic oxygen compound - Organic metalloid moeity - Organochloride - Organofluoride - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyrimidones. These are compounds that contain a pyrimidine ring, which bears a ketone. 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