Compound Identification
SMILES
Cl.Cl.CN1CCN=C(\C=C\C2=CC=CC=C2SCC2=CC=C(Cl)C=C2)C2=CC=CC=C12
InChIKey
InChIKey=XPLXKVQPAOBPCC-BXHFOUFMSA-N
Formula
C25H25Cl3N2S
Mass
491.9
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzodiazepines
- Subclass 1,4-benzodiazepines
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Class
Benzodiazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodiazepines
Subclass
1,4-benzodiazepines
Intermediate Tree Nodes
Not available
Direct Parent
1,4-benzodiazepines
Alternative Parents
Thiophenol ethers Styrenes Dialkylarylamines Chlorobenzenes Alkylarylthioethers Aryl chlorides Ketimines Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organochlorides Hydrochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,4-benzodiazepine - Aryl thioether - Dialkylarylamine - Styrene - Tertiary aliphatic/aromatic amine - Thiophenol ether - Chlorobenzene - Alkylarylthioether - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Ketimine - Tertiary amine - Sulfenyl compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Azacycle - Thioether - Organosulfur compound - Organonitrogen compound - Organochloride - Organohalogen compound - Amine - Imine - Hydrochloride - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1,4-benzodiazepines. These are organic compounds containing a benzene ring fused to a 1,4-azepine.
External Descriptors
Not available