Compound Identification
SMILES
CC1CN2C(=S)NC3=CC=CC(CN1CC=C(C)CCC=C(C)C)=C23
InChIKey
InChIKey=KNAAFAFTKXFVCP-UHFFFAOYSA-N
Formula
C21H29N3S
Mass
355.54
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzodiazepines
- Subclass 1,4-benzodiazepines
-
Class
Benzodiazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodiazepines
Subclass
1,4-benzodiazepines
Intermediate Tree Nodes
Not available
Direct Parent
1,4-benzodiazepines
Alternative Parents
Aromatic monoterpenoids Benzimidazoles Aralkylamines 1,4-diazepines N-substituted imidazoles Imidazolethiones Benzenoids Heteroaromatic compounds Trialkylamines Thioureas Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,4-benzodiazepine - Aromatic monoterpenoid - Monoterpenoid - Benzimidazole - Para-diazepine - Aralkylamine - Benzenoid - N-substituted imidazole - Imidazole-2-thione - Heteroaromatic compound - Imidazole - Azole - Tertiary aliphatic amine - Thiourea - Tertiary amine - Azacycle - Organosulfur compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1,4-benzodiazepines. These are organic compounds containing a benzene ring fused to a 1,4-azepine.
External Descriptors
Not available