Compound Identification
SMILES
COC1=C2N=C(NC(O)=O)SC2=C(C=C1)C1=CSC(=N1)C1=CN=C(C)C=C1
InChIKey
InChIKey=LQPWJEXDJDDZBU-UHFFFAOYSA-N
Formula
C18H14N4O3S2
Mass
398.46
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
Anisoles Methylpyridines Alkyl aryl ethers 2,4-disubstituted thiazoles Heteroaromatic compounds Carbamic acids Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Anisole - Phenol ether - 2,4-disubstituted 1,3-thiazole - Alkyl aryl ether - Methylpyridine - Benzenoid - Pyridine - Azole - Heteroaromatic compound - Thiazole - Carbamic acid - Carbamic acid derivative - Azacycle - Ether - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen 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