Compound Identification
SMILES
OC1S[C@H](C2=CN3C(SC4=C3CCC4)=N2)C(C=O)=CN=C1C(O)=O
InChIKey
InChIKey=DKCLUPJOLOSTIM-NBFOIZRFSA-N
Formula
C15H13N3O4S2
Mass
363.41
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
Beta hydroxy acids and derivatives N-substituted imidazoles Thiazoles Heteroaromatic compounds Ketimines Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Beta-hydroxy acid - Para-thiazepine - Hydroxy acid - N-substituted imidazole - Azole - Imidazole - Heteroaromatic compound - Thiazole - Ketimine - Carboxylic acid derivative - Carboxylic acid - Azacycle - Monocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Imine - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Aldehyde - Aromatic 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