Compound Identification
SMILES
O=C1CSC(=O)C1=CNNC1=NC2=CC=CC=C2O1
InChIKey
InChIKey=ZCKATBJOCOEHRV-UHFFFAOYSA-N
Formula
C12H9N3O3S
Mass
275.28
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
Benzenoids Vinylogous amides Thiolanes Oxazoles Heteroaromatic compounds Carbothioic S-lactones Thiolactones Thioesters Cyclic ketones Oxacyclic compounds Carboxylic acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives Hydrazines and derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazole - Benzenoid - Azole - Oxazole - Thiolane - Heteroaromatic compound - Carbothioic s-lactone - Vinylogous amide - Ketone - Thiocarboxylic acid ester - Thiolactone - Cyclic ketone - Thiocarboxylic acid or derivatives - Carboxylic acid derivative - Oxacycle - Azacycle - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Organooxygen compound - Organonitrogen compound - Hydrazine derivative - Hydrocarbon derivative - Carbonyl group - 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