Compound Identification
SMILES
CC1(C)CC(=O)C2=C(C1)NC1=CC=CC=C1N(C2C1=C(Cl)C=C(Cl)C=C1)C(=S)NC1=CC=CC=C1
InChIKey
InChIKey=ASQFOYSHGKKDDM-UHFFFAOYSA-N
Formula
C28H25Cl2N3OS
Mass
522.49
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
N-phenylthioureas Dichlorobenzenes Secondary alkylarylamines Cyclohexenones 1,4-diazepines Aryl chlorides Vinylogous amides Thioureas Enamines Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodiazepine - N-phenylthiourea - 1,3-dichlorobenzene - Para-diazepine - Halobenzene - Cyclohexenone - Chlorobenzene - Secondary aliphatic/aromatic amine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Vinylogous amide - Ketone - Thiourea - Azacycle - Enamine - Secondary amine - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen 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