Compound Identification
SMILES
CC[C@H](C)C1N2C(NC3=C2C=CC(=C3)C(=O)NCC2=CC(=CC=C2)C(F)(F)F)=C2C=C(NCCOCCOCCN)C=CC2=NC1=O
InChIKey
InChIKey=LGNCALFYCWBJJM-UHWFRNQFSA-N
Formula
C34H39F3N6O4
Mass
652.719
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
Trifluoromethylbenzenes Alpha amino acids and derivatives Benzimidazoles Secondary alkylarylamines Secondary carboxylic acid amides N-acylimines Dialkyl ethers Azacyclic compounds Organofluorides Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,4-benzodiazepine - Alpha-amino acid or derivatives - Trifluoromethylbenzene - Benzimidazole - Secondary aliphatic/aromatic amine - Monocyclic benzene moiety - Benzenoid - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - N-acylimine - Azacycle - Secondary amine - Carboxylic acid derivative - Dialkyl ether - Ether - Hydrocarbon derivative - Organohalogen compound - Primary aliphatic amine - Organofluoride - Organonitrogen compound - Organooxygen compound - Alkyl halide - Carbonyl group - Organic oxide - Organic oxygen compound - Alkyl fluoride - Primary amine - Organic nitrogen 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