Compound Identification
SMILES
COC1=C(C=C(C)C=C1)S(=O)(=O)NC1CCC(CNC2=NC3=C(CCOC4=CC=CC=C34)S2)CC1
InChIKey
InChIKey=FFSKAWSOXFPOPE-UHFFFAOYSA-N
Formula
C26H31N3O4S2
Mass
513.67
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
Benzenesulfonamides Benzenesulfonyl compounds Phenoxy compounds Anisoles Methoxybenzenes Toluenes Alkyl aryl ethers 2-amino-1,3-thiazoles Organosulfonamides Aminosulfonyl compounds Heteroaromatic compounds Azacyclic compounds Oxacyclic compounds Organic oxides Amines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxepine - Benzenesulfonamide - Benzenesulfonyl group - Phenol ether - Methoxybenzene - Phenoxy compound - Anisole - Alkyl aryl ether - Toluene - 1,3-thiazol-2-amine - Benzenoid - Monocyclic benzene moiety - Organosulfonic acid amide - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Aminosulfonyl compound - Thiazole - Sulfonyl - Heteroaromatic compound - Azole - Oxacycle - Azacycle - Ether - Organic oxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Organosulfur 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