Compound Identification
SMILES
NC(N)=NC1NCC(CNC(=O)CN2C3=CC=CC=C3C(CC(O)=O)CCC2=O)S1
InChIKey
InChIKey=RXONJMYEHPOJFB-UHFFFAOYSA-N
Formula
C19H26N6O4S
Mass
434.52
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzazepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzazepines
Alternative Parents
Alpha amino acids and derivatives Azepines Benzenoids Thiazolidines Tertiary carboxylic acid amides Secondary carboxylic acid amides Lactams Guanidines Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Azacyclic compounds Dialkylthioethers Carboxylic acids Carboximidamides Carbonyl compounds Hydrocarbon derivatives Imines Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzazepine - Alpha-amino acid or derivatives - Azepine - Benzenoid - Tertiary carboxylic acid amide - Thiazolidine - Carboxamide group - Guanidine - Lactam - Secondary carboxylic acid amide - Carboxylic acid derivative - Carboxylic acid - Azacycle - Dialkylthioether - Monocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Thioether - Imine - Organic oxide - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzazepines. These are organic compounds containing a benzene ring fused to an azepine ring (unsaturated seven-membered heterocycle with one nitrogen atom replacing a carbon atom).
External Descriptors
Not available