Compound Identification
SMILES
FC1=CC=CC(=C1)C(=O)CSC1=NN=C(NCC=C)S1
InChIKey
InChIKey=HTPDFPDEDZAMGJ-UHFFFAOYSA-N
Formula
C13H12FN3OS2
Mass
309.38
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Aryl ketones
-
Level 7
Phenylketones
- Level 8 Alkyl-phenylketones
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Level 7
Phenylketones
-
Level 6
Aryl ketones
-
Level 5
Ketones
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
Ketones - Aryl ketones - Phenylketones
Direct Parent
Alkyl-phenylketones
Alternative Parents
Benzoyl derivatives Aryl alkyl ketones Fluorobenzenes Alkylarylthioethers 2-amino-5-substituted-1,3,4-thiadiazoles Aryl fluorides Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Benzoyl - Aryl thioether - Aryl alkyl ketone - Fluorobenzene - Halobenzene - Alkylarylthioether - 2-amino-5-substituted-1,3,4-thiadiazole - Aryl fluoride - Aryl halide - Benzenoid - Monocyclic benzene moiety - 2-amino-1,3,4-thiadiazole - Heteroaromatic compound - Azole - Thiadiazole - Organoheterocyclic compound - Azacycle - Sulfenyl compound - Thioether - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.
External Descriptors
Not available