Compound Identification
SMILES
CC1CN2C(=S)NC3=C2C(CN1CC=C(C)C)=C(C=C3)C#C
InChIKey
InChIKey=FXZXYFQUSSNNLA-UHFFFAOYSA-N
Formula
C18H21N3S
Mass
311.45
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzodiazepines
- Subclass 1,4-benzodiazepines
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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
Benzimidazoles Aralkylamines 1,4-diazepines N-substituted imidazoles Imidazolethiones Benzenoids Heteroaromatic compounds Trialkylamines Thioureas Azacyclic compounds Acetylides Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,4-benzodiazepine - Benzimidazole - Para-diazepine - Aralkylamine - Imidazole-2-thione - Benzenoid - N-substituted imidazole - Azole - Imidazole - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Thiourea - Azacycle - Acetylide - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organosulfur 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