Compound Identification
SMILES
CN(C)\C=C\C(=O)C1=NOC(C)=C1C(=O)NC1=NC=CS1
InChIKey
InChIKey=OAEZBRZLHVOXMN-GQCTYLIASA-N
Formula
C13H14N4O3S
Mass
306.34
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 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
Direct Parent
Aryl ketones
Alternative Parents
Vinylogous amides Thiazoles Isoxazoles Heteroaromatic compounds Enones Acryloyl compounds Trialkylamines Secondary carboxylic acid amides Amino acids and derivatives Oxacyclic compounds Enamines Azacyclic compounds Allylamines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl ketone - Acryloyl-group - Azole - Heteroaromatic compound - Enone - Isoxazole - Vinylogous amide - Alpha,beta-unsaturated ketone - Thiazole - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Tertiary aliphatic amine - Tertiary amine - Allylamine - Carboxylic acid derivative - Enamine - Oxacycle - Azacycle - Organoheterocyclic compound - Amine - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aryl ketones. These are organic aromatic compounds that contain a ketone group substituted at one C-atom with an aryl group. They have the generic structure RC(=O)R', where R = aryl group and R'=organyl group.
External Descriptors
Not available