Compound Identification
SMILES
FC(F)(F)[C@@]12CC(=NCCN1CCN2)C1=CC=CS1
InChIKey
InChIKey=KYIDCYRHAOTDIR-LLVKDONJSA-N
Formula
C12H14F3N3S
Mass
289.32
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazepines
- Subclass 1,4-diazepines
-
Class
Diazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazepines
Subclass
1,4-diazepines
Intermediate Tree Nodes
Not available
Direct Parent
1,4-diazepines
Alternative Parents
Thiophenes Imidazolidines Heteroaromatic compounds Ketimines Propargyl-type 1,3-dipolar organic compounds Dialkylamines Azacyclic compounds Aminals Organopnictogen compounds Organofluorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Para-diazepine - Heteroaromatic compound - Thiophene - Imidazolidine - Ketimine - Aminal - Secondary aliphatic amine - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Secondary amine - Organic nitrogen compound - Organohalogen compound - Organofluoride - Imine - Organonitrogen compound - Hydrocarbon derivative - Amine - Organopnictogen compound - Alkyl halide - Alkyl fluoride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1,4-diazepines. These are organic compounds containing 1,4-diazepine, a seven-member heterocyclic ring with two nitrogen atoms in positions 1 and 4.
External Descriptors
Not available