Compound Identification
SMILES
NC1=NC(=O)\C(=N\NC2=CC3=C(C=C2)S(=O)(=O)NC(S3)C(=O)C2=CC=CC=C2)C(N)=N1
InChIKey
InChIKey=OGJPLROHXMMJPO-ZMOGYAJESA-N
Formula
C18H15N7O4S2
Mass
457.48
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
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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
Phenylhydrazines Aryl alkyl ketones Benzoyl derivatives Pyrimidones Alkylarylthioethers Aminopyrimidines and derivatives Organosulfonamides Imidolactams Hydropyrimidines N-acylimines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Hydrazones Carboxylic acids and derivatives Carboximidamides Carboxamidines Hydrocarbon derivatives Amines Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Aryl thioether - Benzoyl - Phenylhydrazine - Aryl alkyl ketone - Aminopyrimidine - Pyrimidone - Alkylarylthioether - Monocyclic benzene moiety - Hydropyrimidine - 5,6-dihydropyrimidine - Pyrimidine - Organosulfonic acid amide - Benzenoid - Imidolactam - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - N-acylimine - Thioether - Amidine - Azacycle - Carboxylic acid amidine - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Hydrazone - Carboxylic acid derivative - Hydrocarbon derivative - Amine - Organic oxide - Organic nitrogen compound - Organonitrogen 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