Compound Identification
SMILES
CN1C2=CC=CC=C2C(=NC(NC(=O)NC2=CC=CC(NC3=CC=CC=C3)=C2)C1=O)C1=CC=CC=C1
InChIKey
InChIKey=PBDYWZQYCKEXIQ-UHFFFAOYSA-N
Formula
C29H25N5O2
Mass
475.552
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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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
N-phenylureas Alpha amino acids and derivatives Aniline and substituted anilines Primary aromatic amines Tertiary carboxylic acid amides Ureas Lactams Ketimines Secondary amines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,4-benzodiazepine - Alpha-amino acid or derivatives - N-phenylurea - Aniline or substituted anilines - Monocyclic benzene moiety - Primary aromatic amine - Benzenoid - Tertiary carboxylic acid amide - Carboxamide group - Ketimine - Amino acid or derivatives - Urea - Lactam - Azacycle - Organic 1,3-dipolar compound - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Secondary amine - Imine - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Amine - 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