Compound Identification
SMILES
CCN(C(=O)[C@@H](C)OC(=O)C1=CC2=C(CCCCC2)S1)C1=CC=CC2=CC=CC=C12
InChIKey
InChIKey=XDLHVCAFNYRRDC-QGZVFWFLSA-N
Formula
C25H27NO3S
Mass
421.56
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
Naphthalenes Thiophene carboxylic acids and derivatives 2,3,5-trisubstituted thiophenes Tertiary carboxylic acid amides Heteroaromatic compounds Carboxylic acid esters Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cycloheptathiophene - Naphthalene - Thiophene carboxylic acid or derivatives - 2,3,5-trisubstituted thiophene - Benzenoid - Tertiary carboxylic acid amide - Thiophene - Heteroaromatic compound - Carboxylic acid ester - Carboxamide group - Carboxylic acid derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - 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