Compound Identification
SMILES
CCC1=CC2=C(NCCCO)NC3=C(C=CC(F)=C3)N=C2S1
InChIKey
InChIKey=CIKSPMFERKTNTC-UHFFFAOYSA-N
Formula
C16H18FN3OS
Mass
319.4
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
Thienodiazepines 1,4-diazepines Benzenoids Aryl fluorides Thiophenes Heteroaromatic compounds Azacyclic compounds Alkanolamines Primary alcohols Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodiazepine - Thieno-para-diazepine - Para-diazepine - Aryl fluoride - Aryl halide - Benzenoid - Thiophene - Heteroaromatic compound - Alkanolamine - Azacycle - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic oxygen compound - Alcohol - Organic nitrogen 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