Compound Identification
SMILES
CCOC(=O)C1=NC2=C(NC3=CC=CC=C3N=C2S1)N1CCN[C@@H](CCOC)C1
InChIKey
InChIKey=GGIWFGAPWBBHPV-ZDUSSCGKSA-N
Formula
C20H25N5O3S
Mass
415.51
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
Thiazolecarboxylic acids and derivatives 1,4-diazepines Piperazines Benzenoids Heteroaromatic compounds Carboxylic acid esters Amino acids and derivatives Dialkylamines Dialkyl ethers Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodiazepine - Thiazolecarboxylic acid or derivatives - Para-diazepine - Benzenoid - 1,4-diazinane - Piperazine - Azole - Heteroaromatic compound - Thiazole - Amino acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Dialkyl ether - Secondary aliphatic amine - Secondary amine - Ether - Amine - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - 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