Compound Identification
SMILES
CN1C(=O)SC2=C1C=CC(=C2)N1C[C@H](CNC(N)=S)OC1=O
InChIKey
InChIKey=UNVDWGYYIAPWCD-QMMMGPOBSA-N
Formula
C13H14N4O3S2
Mass
338.4
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzothiazoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzothiazoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzothiazoles
Alternative Parents
Oxazolidinones Benzenoids Thiazoles Heteroaromatic compounds Carbamate esters Thioureas Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Oxazolidinone - Benzenoid - Azole - Oxazolidine - Heteroaromatic compound - Thiazole - Carbamic acid ester - Thiourea - Oxacycle - Azacycle - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzothiazoles. These are organic compounds containing a benzene fused to a thiazole ring (a five-membered ring with four carbon atoms, one nitrogen atom and one sulfur atom).
External Descriptors
Not available