Compound Identification
SMILES
CN1CCC2(CCN(C2)C(=O)N2C3N=CC=CC3NC(=O)C3=CC=CC=C23)C1
InChIKey
InChIKey=XFNNLHFCXUKZJS-UHFFFAOYSA-N
Formula
C21H25N5O2
Mass
379.464
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
Diazaspirononane derivatives Pyrrolidinecarboxamides Benzenoids N-alkylpyrrolidines Vinylogous amides Ureas Lactams Amino acids and derivatives Secondary carboxylic acid amides Trialkylamines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxides Imines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,4-benzodiazepine - Diazaspirononane - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-1-carboxamide - Benzenoid - N-alkylpyrrolidine - Vinylogous amide - Pyrrolidine - Amino acid or derivatives - Carboxamide group - Lactam - Urea - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organonitrogen compound - Hydrocarbon derivative - Imine - Organic oxide - Amine - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Carbonyl group - 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