Compound Identification
SMILES
COC1=C2SC(=NC2=C(OC)C=C1)N(CC1=CC=CO1)C(=O)C1=CC=C(Br)S1
InChIKey
InChIKey=YLCRPKHVASCDFK-UHFFFAOYSA-N
Formula
C19H15BrN2O4S2
Mass
479.36
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
Thiophene carboxamides 2-heteroaryl carboxamides Anisoles 2,5-disubstituted thiophenes Alkyl aryl ethers Aryl bromides Thiazoles Tertiary carboxylic acid amides Furans Heteroaromatic compounds Tertiary amines Amino acids and derivatives Azacyclic compounds Oxacyclic compounds Organobromides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Anisole - 2-heteroaryl carboxamide - Phenol ether - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - 2,5-disubstituted thiophene - Alkyl aryl ether - Aryl bromide - Aryl halide - Benzenoid - Heteroaromatic compound - Azole - Furan - Tertiary carboxylic acid amide - Thiazole - Thiophene - Tertiary amine - Amino acid or derivatives - Carboxamide group - Oxacycle - Azacycle - Ether - Carboxylic acid derivative - Organooxygen compound - Organic oxide - Amine - Organic oxygen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Hydrocarbon derivative - 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