Compound Identification
SMILES
CN1CCN(CC1)C1=NC2=C(OC3=C1C=C(Cl)C=C3)SC=C2
InChIKey
InChIKey=YAELGXKPWXPGQB-UHFFFAOYSA-N
Formula
C16H16ClN3OS
Mass
333.83
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
Diarylethers N-methylpiperazines Imidolactams Benzenoids Aryl chlorides Thiophenes Heteroaromatic compounds Trialkylamines Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Carboxamidines Azacyclic compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazepine - Diaryl ether - N-alkylpiperazine - N-methylpiperazine - Aryl chloride - Aryl halide - 1,4-diazinane - Imidolactam - Piperazine - Benzenoid - Heteroaromatic compound - Thiophene - Tertiary amine - Tertiary aliphatic amine - Amidine - Organic 1,3-dipolar compound - Ether - Azacycle - Oxacycle - Carboxylic acid amidine - Propargyl-type 1,3-dipolar organic compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Amine - 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