Compound Identification
SMILES
CCOC(=O)C1CCCN(C1)C1=CC2=C(C=C1)N1C(NCCCCC(=O)C(F)(F)F)C(=O)N=C3C=CC(NC4CC4)=CC3=C1N2
InChIKey
InChIKey=FKWSPMICGXSENO-UHFFFAOYSA-N
Formula
C32H37F3N6O4
Mass
626.681
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
Alpha amino acids and derivatives Piperidinecarboxylic acids Benzimidazoles Dialkylarylamines Secondary alkylarylamines Benzenoids Alpha-haloketones N-acylimines Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,4-benzodiazepine - Alpha-amino acid or derivatives - Benzimidazole - Piperidinecarboxylic acid - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Secondary aliphatic/aromatic amine - Benzenoid - Piperidine - Alpha-haloketone - N-acylimine - Tertiary amine - Amino acid or derivatives - Carboxylic acid ester - Ketone - Azacycle - Secondary amine - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Alkyl fluoride - Amine - Alkyl halide - Organic oxide - 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