Compound Identification
SMILES
CCCCCOC1=CC=CC=C1[C@@H]1OC2=C(N=NC(SC)=N2)C2=CC=CC=C2N1C(=O)CC
InChIKey
InChIKey=AVAFZNKHZKHXKL-DEOSSOPVSA-N
Formula
C25H28N4O3S
Mass
464.58
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzoxazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxazepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzoxazepines
Alternative Parents
Phenoxy compounds Phenol ethers Alkylarylthioethers Alkyl aryl ethers 1,3-oxazepines 1,2,4-triazines Tertiary carboxylic acid amides Heteroaromatic compounds Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazepine - Phenoxy compound - Aryl thioether - Phenol ether - Meta-oxazepine - Alkyl aryl ether - Alkylarylthioether - Monocyclic benzene moiety - 1,2,4-triazine - Benzenoid - Triazine - Heteroaromatic compound - Tertiary carboxylic acid amide - Carboxamide group - Oxacycle - Carboxylic acid derivative - Ether - Azacycle - Sulfenyl compound - Thioether - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoxazepines. These are organic compounds containing a benzene fused to an oxazepine ring (a seven-membered ring with four carbon atoms, one oxygen atom, and a nitrogen atom).
External Descriptors
Not available