Compound Identification
SMILES
CCSC1=NC=C(C(=O)C2=CC=CC=C2OC)C(N)=N1
InChIKey
InChIKey=MFDCPPODFATVOV-UHFFFAOYSA-N
Formula
C14H15N3O2S
Mass
289.35
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
-
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
Pyrimidinecarboxylic acids and derivatives Phenoxy compounds Methoxybenzenes Anisoles Benzoyl derivatives Alkyl aryl ethers Alkylarylthioethers Aminopyrimidines and derivatives Imidolactams Vinylogous amides Heteroaromatic compounds Sulfenyl compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Primary amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl-phenylketone - Pyrimidine-5-carboxylic acid or derivatives - Phenol ether - Benzoyl - Methoxybenzene - Anisole - Phenoxy compound - Aryl thioether - Alkyl aryl ether - Alkylarylthioether - Aminopyrimidine - Pyrimidine - Monocyclic benzene moiety - Benzenoid - Imidolactam - Vinylogous amide - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Ether - Sulfenyl compound - Thioether - Organic oxide - Amine - Organic nitrogen compound - Organonitrogen compound - Organosulfur compound - Hydrocarbon derivative - 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