Compound Identification
SMILES
COC1=CC=C(C=C1)C(=O)\C=C\C1=CC=CN(C2=CC=C(Cl)C=C2)C1=S
InChIKey
InChIKey=XAWWQUWHFNPDQI-AWNIVKPZSA-N
Formula
C21H16ClNO2S
Mass
381.87
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
Phenoxy compounds Anisoles Aryl ketones Methoxybenzenes Alkyl aryl ethers Chlorobenzenes Dihydropyridines Aryl chlorides Acryloyl compounds Thiolactams Enones Heteroaromatic compounds Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Organosulfur compounds Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Benzoyl - Aryl ketone - Halobenzene - Alkyl aryl ether - Dihydropyridine - Chlorobenzene - Hydropyridine - Aryl chloride - Aryl halide - Pyridine - Heteroaromatic compound - Acryloyl-group - Enone - Thiolactam - Alpha,beta-unsaturated ketone - Ketone - Azacycle - Organoheterocyclic compound - Ether - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organochloride - Organohalogen compound - 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