Compound Identification
SMILES
O=C(CSC1=NC2=C(SC3=NC(=NC(=C23)C2=CC=CC=C2)C2=CC=CC=C2)C2=NCCN12)C1=CC=CC=C1
InChIKey
InChIKey=PYCTZRBDSWIRFP-UHFFFAOYSA-N
Formula
C30H21N5OS2
Mass
531.65
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
Phenylpyrimidines Thienopyrimidines Aryl alkyl ketones Benzoyl derivatives Imidolactams Thiophenes Heteroaromatic compounds Imidazolines Isothioureas Sulfenyl compounds Azacyclic compounds Carboximidamides Carboxamidines Propargyl-type 1,3-dipolar organic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - 4-phenylpyrimidine - Thienopyrimidine - Benzoyl - Aryl alkyl ketone - Monocyclic benzene moiety - Pyrimidine - Imidolactam - Benzenoid - 2-imidazoline - Heteroaromatic compound - Thiophene - Isothiourea - Carboximidamide - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Azacycle - Amidine - Carboxylic acid amidine - Sulfenyl compound - Organosulfur compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - 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