Compound Identification
SMILES
ClC1=CC2=C(OC(=C2)C(=O)NNC(=O)CSC2=NC3=CC=CC=C3O2)C=C1
InChIKey
InChIKey=NMTXWYZUFQAIRQ-UHFFFAOYSA-N
Formula
C18H12ClN3O4S
Mass
401.82
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
Benzofurans Furoic acid and derivatives Alkylarylthioethers Aryl chlorides Benzenoids Oxazoles Heteroaromatic compounds Carboxylic acid hydrazides Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Organochlorides Carbonyl compounds Organonitrogen compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzofuran - Benzoxazole - Furoic acid or derivatives - Aryl thioether - Alkylarylthioether - Aryl chloride - Aryl halide - Benzenoid - Azole - Heteroaromatic compound - Furan - Oxazole - Carboxylic acid hydrazide - Oxacycle - Carboxylic acid derivative - Azacycle - Sulfenyl compound - Thioether - Organohalogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - 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