Compound Identification
SMILES
CN(C)CCSC1=NC2=CC=CC=C2C2=C1CCOC1=CC=CC=C21
InChIKey
InChIKey=RBSAECWKODMNRM-UHFFFAOYSA-N
Formula
C21H22N2OS
Mass
350.48
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzoxepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzoxepines
Alternative Parents
Quinolines and derivatives Alkylarylthioethers Alkyl aryl ethers Pyridines and derivatives Benzenoids Heteroaromatic compounds Trialkylamines Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxepine - Quinoline - Aryl thioether - Alkyl aryl ether - Alkylarylthioether - Pyridine - Benzenoid - Heteroaromatic compound - Tertiary amine - Tertiary aliphatic amine - Ether - Oxacycle - Azacycle - Thioether - Sulfenyl compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Amine - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoxepines. These are organic compounds containing a benzene ring fused to an oxepine ring (an unsaturated seven-membered heterocycle with one oxygen atom replacing a carbon atom).
External Descriptors
Not available