Compound Identification
SMILES
COC1=C(OC)C(OC)=C(C=C1)C(N1CCCNCC1)C1=NC2=CC=CC=C2S1
InChIKey
InChIKey=OTENCYBENNVUHB-UHFFFAOYSA-N
Formula
C22H27N3O3S
Mass
413.54
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
Phenoxy compounds Methoxybenzenes Anisoles Aralkylamines Alkyl aryl ethers 1,4-diazepanes Thiazoles Heteroaromatic compounds Trialkylamines Dialkylamines Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-benzothiazole - Anisole - Phenoxy compound - Phenol ether - Methoxybenzene - 1,4-diazepane - Alkyl aryl ether - Diazepane - Aralkylamine - Benzenoid - Monocyclic benzene moiety - Thiazole - Heteroaromatic compound - Azole - Tertiary aliphatic amine - Tertiary amine - Secondary amine - Azacycle - Ether - Secondary aliphatic amine - Hydrocarbon derivative - Organic oxygen compound - Amine - Organonitrogen compound - Organic nitrogen compound - Organooxygen 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