Compound Identification
SMILES
CCC1COC2=C1SC(N)=CN=C2
InChIKey
InChIKey=ZRZDQIJAMHFWMR-UHFFFAOYSA-N
Formula
C9H12N2OS
Mass
196.27
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Thiazepines
- Subclass Para thiazepines
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Class
Thiazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thiazepines
Subclass
Para thiazepines
Intermediate Tree Nodes
Not available
Direct Parent
Para thiazepines
Alternative Parents
Dihydrofurans Thioenol ethers Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Organooxygen compounds Imines Hydrocarbon derivatives Amines
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Para-thiazepine - Dihydrofuran - Thioenolether - Oxacycle - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Imine - Amine - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as para thiazepines. These are compounds containing a para thiazepine moiety, which consists of an unsaturated seven-member ring with one nitrogen atom and one sulfur at positions 1 and 4, respectively, as well as two CC double bonds.
External Descriptors
Not available