Compound Identification
SMILES
COCC[C@H]1CN(CCN1)C1=NC2=C(NC3=C1C=CS3)C=C(F)C=C2
InChIKey
InChIKey=BXDQIKKBTNXABY-ZDUSSCGKSA-N
Formula
C18H21FN4OS
Mass
360.45
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 N-arylated-2-aminothiophenes 1,4-diazepines Piperazines Imidolactams Benzenoids Aryl fluorides Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Dialkylamines Dialkyl ethers Carboxamidines Azacyclic compounds Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodiazepine - Thieno-para-diazepine - Para-diazepine - N-arylated-2-aminothiophene - Aryl fluoride - Aryl halide - 2-aminothiophene - Imidolactam - 1,4-diazinane - Piperazine - Benzenoid - Heteroaromatic compound - Thiophene - Amidine - Azacycle - Carboxylic acid amidine - Dialkyl ether - Secondary aliphatic amine - Organic 1,3-dipolar compound - Ether - Propargyl-type 1,3-dipolar organic compound - Secondary amine - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen 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