Compound Identification
SMILES
CN1C2=C(CNCCC2)C2=C1C=C(C=C2)N1C=CC(=CC1=O)C1=NN=C(C=C1)C(F)(F)F
InChIKey
InChIKey=DTMGSSYHCAMZHW-UHFFFAOYSA-N
Formula
C23H20F3N5O
Mass
439.442
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyrroloazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrroloazepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pyrroloazepines
Alternative Parents
3-alkylindoles N-alkylindoles Pyridinones Aralkylamines Azepines Dihydropyridines Pyridazines and derivatives N-methylpyrroles Benzenoids Heteroaromatic compounds Lactams Azacyclic compounds Dialkylamines Hydrocarbon derivatives Organic oxides Organofluorides Alkyl fluorides Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-alkylindole - Pyrroloazepine - 3-alkylindole - Indole - Indole or derivatives - Azepine - Dihydropyridine - Pyridinone - Aralkylamine - Hydropyridine - N-methylpyrrole - Pyridazine - Pyridine - Substituted pyrrole - Benzenoid - Pyrrole - Heteroaromatic compound - Lactam - Secondary aliphatic amine - Secondary amine - Azacycle - Organic nitrogen compound - Alkyl halide - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Alkyl fluoride - Organic oxygen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrroloazepines. These are compounds containing a pyrroloazepine moiety, which is a bicyclic heterocycle which consists of a pyrrole ring fused to an azepine. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Azepine is a 7-membered ring consisting of six carbon and one nitrogen atom.
External Descriptors
Not available