Compound Identification
SMILES
COC1=CC2=C(C=C1)C1=C(CCS2)C2=CC=CC=C2N1CCCCCN1CCCCC1
InChIKey
InChIKey=BYKNIYOXNLLYKG-UHFFFAOYSA-N
Formula
C27H34N2OS
Mass
434.64
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzothiepins
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzothiepins
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzothiepins
Alternative Parents
N-alkylindoles 3-alkylindoles Anisoles Alkylarylthioethers Alkyl aryl ethers Substituted pyrroles Piperidines Heteroaromatic compounds Trialkylamines Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzothiepin - N-alkylindole - 3-alkylindole - Indole - Indole or derivatives - Anisole - Aryl thioether - Phenol ether - Alkyl aryl ether - Alkylarylthioether - Substituted pyrrole - Piperidine - Benzenoid - Pyrrole - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Thioether - Azacycle - Ether - Organooxygen compound - Hydrocarbon derivative - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzothiepins. These are organic compounds containing a benzene fused to a thiepine ring (a seven-membered ring with six carbon atoms and one sulfur atom).
External Descriptors
Not available