Compound Identification
SMILES
CC(=O)C1=CC=C(C=C1)C1=CC=C(O1)\C=C1/SC2=NC(=NN2C1=O)C1=CC=C(C)C=C1
InChIKey
InChIKey=XJMVUZXNUXUBLW-BKUYFWCQSA-N
Formula
C24H17N3O3S
Mass
427.48
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
Phenyl-1,2,4-triazoles Acetophenones Triazolothiazoles Aryl alkyl ketones Benzoyl derivatives Toluenes Thiazoles Furans Heteroaromatic compounds Lactams Oxacyclic compounds Azacyclic compounds Organic oxides Organonitrogen compounds Organopnictogen compounds Aldehydes Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Phenyltriazole - Phenyl-1,2,4-triazole - Acetophenone - Benzoyl - Triazolothiazole - Aryl alkyl ketone - Toluene - Monocyclic benzene moiety - Benzenoid - Azole - Furan - Thiazole - Triazole - 1,2,4-triazole - Heteroaromatic compound - Lactam - Oxacycle - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organonitrogen compound - Aldehyde - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Aromatic heteropolycyclic 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