Compound Identification
SMILES
CC1=CC2=C(NC3=C(C(N2)C2=C(C=CC=C2F)C(F)(F)F)C(=O)CC2(CCCC2)C3)C=C1
InChIKey
InChIKey=DOAKAPZVAOXJFN-UHFFFAOYSA-N
Formula
C25H24F4N2O
Mass
444.474
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzodiazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodiazepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzodiazepines
Alternative Parents
Trifluoromethylbenzenes Diaminotoluenes Secondary alkylarylamines Fluorobenzenes Cyclohexenones Aralkylamines 1,4-diazepines Aryl fluorides Vinylogous amides Enamines Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodiazepine - Trifluoromethylbenzene - Diaminotoluene - Para-diazepine - Fluorobenzene - Cyclohexenone - Halobenzene - Secondary aliphatic/aromatic amine - Aralkylamine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Vinylogous amide - Ketone - Secondary amine - Azacycle - Enamine - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Carbonyl group - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Organofluoride - Organonitrogen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzodiazepines. These are organic compounds containing a benzene ring fused to either isomers of diazepine(unsaturated seven-member heterocycle with two nitrogen atoms replacing two carbon atoms).
External Descriptors
Not available