Compound Identification
SMILES
O=C1CC(C2=CC=CS2)C2=C(CCCC2=O)N1C1=C(C#N)C2=C(CCCCC2)S1
InChIKey
InChIKey=IMDSMJURPQMSIS-UHFFFAOYSA-N
Formula
C23H22N2O2S2
Mass
422.56
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
Tetrahydropyridines Cyclohexenones Vinylogous amides Thiophenes Tertiary carboxylic acid amides Heteroaromatic compounds Lactams Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cycloheptathiophene - Tetrahydropyridine - Cyclohexenone - Tertiary carboxylic acid amide - Thiophene - Vinylogous amide - Heteroaromatic compound - Carboxamide group - Lactam - Ketone - Azacycle - Nitrile - Carbonitrile - Carboxylic acid derivative - Carbonyl group - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Cyanide - Organic oxide - 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