Compound Identification
SMILES
CC1=C(C)C2=C(C3=CC=C(OS(C)(=O)=O)C=C3)C3=CC=CC=C3C=C2S1
InChIKey
InChIKey=KHRNWPFHHRZBJP-UHFFFAOYSA-N
Formula
C21H18O3S2
Mass
382.49
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Naphthalenes
- Subclass Naphthothiophenes
-
Class
Naphthalenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Naphthalenes
Subclass
Naphthothiophenes
Intermediate Tree Nodes
Not available
Direct Parent
Naphthothiophenes
Alternative Parents
1-benzothiophenes Phenoxy compounds Sulfonic acid esters Organosulfonic acid esters Thiophenes Sulfonyls Methanesulfonates Heteroaromatic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Naphthothiophene - Benzothiophene - 1-benzothiophene - Phenoxy compound - Monocyclic benzene moiety - Organosulfonic acid ester - Sulfonic acid ester - Methanesulfonate - Heteroaromatic compound - Thiophene - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Organoheterocyclic compound - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as naphthothiophenes. These are compounds containing a naphthalene (or a derivative) fused to thiophene.
External Descriptors
Not available