Compound Identification
SMILES
C\C(N(CC1=CN=C(C)N=C1N)C=O)=C(\CCO)S\C=C\C(=O)C1=CC=CC=C1
InChIKey
InChIKey=IYLXFMHBICTCPI-KWKPKBFNSA-N
Formula
C21H24N4O3S
Mass
412.51
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzoyl derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoyl derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzoyl derivatives
Alternative Parents
Aryl ketones Aminopyrimidines and derivatives Vinylogous thioesters Imidolactams Tertiary carboxylic acid amides Acryloyl compounds Enones Heteroaromatic compounds Thioenol ethers Amino acids and derivatives Sulfenyl compounds Azacyclic compounds Organic oxides Primary alcohols Primary amines Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoyl - Aryl ketone - Aminopyrimidine - Vinylogous thioester - Imidolactam - Pyrimidine - Acryloyl-group - Heteroaromatic compound - Enone - Alpha,beta-unsaturated ketone - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Ketone - Thioenolether - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Sulfenyl compound - Organonitrogen compound - Organic oxygen compound - Amine - Alcohol - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organosulfur compound - Primary alcohol - Primary amine - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzoyl derivatives. These are organic compounds containing an acyl moiety of benzoic acid with the formula (C6H5CO-).
External Descriptors
Not available