Compound Identification
SMILES
COC1=CC=C(C=C1)N1N=C2C(CC1=O)CCCC1=C2C=C(C)S1
InChIKey
InChIKey=XZFFJKDULWTINY-UHFFFAOYSA-N
Formula
C19H20N2O2S
Mass
340.44
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
Methoxyanilines Phenoxy compounds Methoxybenzenes Anisoles 2,3,5-trisubstituted thiophenes Pyridazinones Alkyl aryl ethers Heteroaromatic compounds Carboxylic acids and derivatives Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cycloheptathiophene - Methoxyaniline - Anisole - Phenoxy compound - Phenol ether - 2,3,5-trisubstituted thiophene - Methoxybenzene - Alkyl aryl ether - Pyridazinone - Benzenoid - Pyridazine - Monocyclic benzene moiety - Thiophene - Heteroaromatic compound - Ether - Carboxylic acid derivative - Azacycle - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Carbonyl group - 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