Compound Identification
SMILES
ClC1=C(\C=C(/C#N)C(=O)C2=CC=CC=C2)N2C=CSC2=N1
InChIKey
InChIKey=DTUQXHIWUZFNNX-DHZHZOJOSA-N
Formula
C15H8ClN3OS
Mass
313.76
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 N-substituted imidazoles Aryl chlorides Alpha-branched alpha,beta-unsaturated ketones Thiazoles Heteroaromatic compounds Enones Acryloyl compounds Nitriles Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoyl - Aryl ketone - Aryl chloride - Aryl halide - Alpha-branched alpha,beta-unsaturated-ketone - N-substituted imidazole - Acryloyl-group - Azole - Heteroaromatic compound - Enone - Imidazole - Alpha,beta-unsaturated ketone - Thiazole - Ketone - Azacycle - Organoheterocyclic compound - Carbonitrile - Nitrile - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Cyanide - Organohalogen compound - Organochloride - Aromatic heteropolycyclic 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