Compound Identification
SMILES
NC1=C(C(=O)C2=CC=C(Cl)C=C2)C2=C(CN(CC=C)CC2)S1
InChIKey
InChIKey=JEHXJTDSXYWRHI-UHFFFAOYSA-N
Formula
C17H17ClN2OS
Mass
332.85
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 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
2-amino-3-benzoylthiophenes Thienopyridines 3,4,5-trisubstituted-2-aminothiophenes Thiophene carboxylic acids and derivatives Benzoyl derivatives Aralkylamines Chlorobenzenes Aryl chlorides Vinylogous amides Heteroaromatic compounds Trialkylamines Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organopnictogen compounds Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-amino-3-benzoylthiophene - Aryl-phenylketone - 3-aroylthiophene - Thienopyridine - 3,4,5-trisubstituted-2-aminothiophene - Thiophene carboxylic acid or derivatives - Benzoyl - Aralkylamine - Halobenzene - Chlorobenzene - 2-aminothiophene - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Thiophene - Vinylogous amide - Heteroaromatic compound - Tertiary amine - Tertiary aliphatic amine - Organoheterocyclic compound - Azacycle - Primary amine - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Amine - Aromatic heteropolycyclic 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