Compound Identification
SMILES
COC(=O)C1=C(NC(=O)CCCS(=O)(=O)C2=CC=C(F)C=C2)SC2=C1CCCCC2
InChIKey
InChIKey=DQGSDSFJPFMRJX-UHFFFAOYSA-N
Formula
C21H24FNO5S2
Mass
453.54
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Cycloheptathiophenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Cycloheptathiophenes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Cycloheptathiophenes
Alternative Parents
Benzenesulfonyl compounds Thiophene carboxylic acids and derivatives N-arylamides Fluorobenzenes Fatty amides Aryl fluorides Vinylogous amides Sulfones Methyl esters Heteroaromatic compounds Secondary carboxylic acid amides Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cycloheptathiophene - Benzenesulfonyl group - Thiophene carboxylic acid or derivatives - N-arylamide - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Fatty amide - Benzenoid - Fatty acyl - Sulfonyl - Sulfone - Vinylogous amide - Methyl ester - Heteroaromatic compound - Thiophene - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid ester - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organosulfur compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cycloheptathiophenes. These are polycyclic compounds containing a thiophene ring fused to a 7 member carbocyclic moiety. Thiophene is 5-membered ring consisting of four carbon atoms and one sulfur atom.
External Descriptors
Not available