Compound Identification
SMILES
NC1=C(SC(NC2=CC=C(C=C2)N2CCNCC2)=N1)C(=O)C1=CC(OC(F)F)=CC=C1
InChIKey
InChIKey=HCEYYJBLZZVAHR-UHFFFAOYSA-N
Formula
C21H21F2N5O2S
Mass
445.49
Taxonomic Classification
Taxonomy Tree
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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 Aryl-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
Aryl-phenylketones
Alternative Parents
Phenylpiperazines N-arylpiperazines 2,4,5-trisubstituted thiazoles Phenoxy compounds Phenol ethers Aniline and substituted anilines Dialkylarylamines Benzoyl derivatives 2-amino-1,3-thiazoles Imidolactams Vinylogous amides Heteroaromatic compounds Azacyclic compounds Dialkylamines Hydrocarbon derivatives Organic oxides Alkyl fluorides Organofluorides Primary amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl-phenylketone - N-arylpiperazine - Phenylpiperazine - Tertiary aliphatic/aromatic amine - 2,4,5-trisubstituted 1,3-thiazole - Phenol ether - Benzoyl - Dialkylarylamine - Aniline or substituted anilines - Phenoxy compound - Imidolactam - 1,4-diazinane - 1,3-thiazol-2-amine - Monocyclic benzene moiety - Piperazine - Benzenoid - 1,3-thiazolamine - Azole - Thiazole - Vinylogous amide - Heteroaromatic compound - Tertiary amine - Azacycle - Organoheterocyclic compound - Secondary aliphatic amine - Secondary amine - Amine - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - Primary amine - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aryl-phenylketones. These are aromatic compounds containing a ketone substituted by one aryl group, and a phenyl group.
External Descriptors
Not available