Compound Identification
SMILES
ClC1=CC2=C(C=C1)N(CC#N)C(=O)CNC2=C1C=CC(=O)C=C1
InChIKey
InChIKey=WDZVMRXKVHAKOS-UHFFFAOYSA-N
Formula
C17H12ClN3O2
Mass
325.75
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
Alpha amino acids and derivatives P-quinomethanes Benzenoids Aryl chlorides Tertiary carboxylic acid amides Lactams Nitriles Enamines Dialkylamines Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,4-benzodiazepine - Alpha-amino acid or derivatives - Quinomethane - P-quinomethane - Aryl chloride - Aryl halide - Benzenoid - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Ketone - Cyclic ketone - Lactam - Carboxylic acid derivative - Secondary aliphatic amine - Enamine - Azacycle - Secondary amine - Carbonitrile - Nitrile - Organic oxygen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Cyanide - Organic oxide - Carbonyl group - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen 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