Compound Identification
SMILES
ClC1=CN=C(NC(=S)NC2=CC=C(C=C2)C2OC3=CC=CC=C3N3C=CC=C3C2=O)C=C1
InChIKey
InChIKey=KUGSFNLAJWPKER-UHFFFAOYSA-N
Formula
C24H17ClN4O2S
Mass
460.94
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
N-phenylthioureas Aryl alkyl ketones Alkyl aryl ethers Pyridines and derivatives Aryl chlorides Imidolactams Pyrroles Heteroaromatic compounds Thioureas Oxacyclic compounds Azacyclic compounds Organochlorides Aldehydes Organonitrogen compounds Organopnictogen compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazepine - N-phenylthiourea - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Imidolactam - Benzenoid - Pyridine - Heteroaromatic compound - Pyrrole - Ketone - Thiourea - Ether - Oxacycle - Azacycle - Organochloride - Organohalogen compound - Organic nitrogen compound - Aldehyde - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - 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