Compound Identification
SMILES
CCNC1=NC(N)=C(S1)C(=O)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=FMWOBSRFNVLETF-UHFFFAOYSA-N
Formula
C12H12ClN3OS
Mass
281.76
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
Benzoyl derivatives 2,4,5-trisubstituted thiazoles Secondary alkylarylamines Chlorobenzenes Imidolactams Aryl chlorides 2-amino-1,3-thiazoles Vinylogous amides Heteroaromatic compounds Azacyclic compounds Primary amines Organopnictogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl-phenylketone - 2,4,5-trisubstituted 1,3-thiazole - Benzoyl - Chlorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - 1,3-thiazolamine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Imidolactam - 1,3-thiazol-2-amine - Heteroaromatic compound - Azole - Vinylogous amide - Thiazole - Secondary amine - Azacycle - Organoheterocyclic compound - Primary amine - Organic oxide - Organopnictogen compound - Hydrocarbon derivative - Amine - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - 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