Compound Identification
SMILES
O=C1NC(=S)NC(CSC2=NC3=CC=CC=C3O2)=C1
InChIKey
InChIKey=ZBZUSIRGXUAECB-UHFFFAOYSA-N
Formula
C12H9N3O2S2
Mass
291.34
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-Thiopyrimidines Alkylarylthioethers Pyrimidones Pyrimidinethiones Benzenoids Hydropyrimidines Vinylogous amides Heteroaromatic compounds Oxazoles Lactams Thioureas Azacyclic compounds Sulfenyl compounds Oxacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Organooxygen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazole - Aryl thioether - 2-thiopyrimidine - Thiopyrimidine - Pyrimidinethione - Alkylarylthioether - Pyrimidone - Hydropyrimidine - Pyrimidine - Benzenoid - Azole - Oxazole - Heteroaromatic compound - Vinylogous amide - Lactam - Thiourea - Thioether - Sulfenyl compound - Azacycle - Oxacycle - Organic nitrogen compound - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organopnictogen compound - Organic oxygen 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