Compound Identification
SMILES
CC1=CC2=C(OC(SCC3=NC(=CO3)C(=O)NCCC3=C(Cl)C=C(Cl)C=C3)=N2)C=C1
InChIKey
InChIKey=YAMHVSJEHZQAEG-UHFFFAOYSA-N
Formula
C21H17Cl2N3O3S
Mass
462.35
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzoxazoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxazoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzoxazoles
Alternative Parents
2-heteroaryl carboxamides Dichlorobenzenes 2,4-disubstituted oxazoles Alkylarylthioethers Aryl chlorides Heteroaromatic compounds Secondary carboxylic acid amides Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds Organooxygen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazole - 2-heteroaryl carboxamide - 1,3-dichlorobenzene - Aryl thioether - Halobenzene - 2,4-disubstituted 1,3-oxazole - Chlorobenzene - Alkylarylthioether - Aryl chloride - Benzenoid - Monocyclic benzene moiety - Aryl halide - Oxazole - Heteroaromatic compound - Azole - Carboxamide group - Secondary carboxylic acid amide - Oxacycle - Azacycle - Carboxylic acid derivative - Sulfenyl compound - Thioether - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organosulfur compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoxazoles. These are organic compounds containing a benzene fused to an oxazole ring Oxazole is five-membered aromatic ring with a nitrogen and an oxygen atoms at the 1- and 3-position, respectively.
External Descriptors
Not available