Compound Identification
SMILES
Cl.CN1C(CNC(=O)C2=CC=C(C=C2)C#N)CN=C(C2=CC=CC=C2F)C2=CC=CC=C12
InChIKey
InChIKey=GZACRXILTBEUDR-UHFFFAOYSA-N
Formula
C25H22ClFN4O
Mass
448.93
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzodiazepines
- Subclass 1,4-benzodiazepines
-
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
Benzamides Benzonitriles Dialkylarylamines Benzoyl derivatives Fluorobenzenes Aryl fluorides Secondary carboxylic acid amides Amino acids and derivatives Ketimines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Nitriles Hydrocarbon derivatives Hydrochlorides Organic oxides Organofluorides Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,4-benzodiazepine - Benzoic acid or derivatives - Benzamide - Tertiary aliphatic/aromatic amine - Benzoyl - Dialkylarylamine - Benzonitrile - Fluorobenzene - Halobenzene - Benzenoid - Aryl fluoride - Monocyclic benzene moiety - Aryl halide - Secondary carboxylic acid amide - Carboxamide group - Tertiary amine - Ketimine - Amino acid or derivatives - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Carbonitrile - Nitrile - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Hydrochloride - Amine - Hydrocarbon derivative - Organonitrogen compound - Imine - Organofluoride - Cyanide - Organic oxide - Organohalogen 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