Compound Identification
SMILES
CN1[C@H]2SS[C@@](Cc3ccc(OCC=C(C)C)cc3)(N(C)C2=O)C1=O
InChIKey
InChIKey=JSIYDGFKARPHEZ-FUHWJXTLSA-N
Formula
C18H22N2O3S2
Mass
378.51
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazinanes
-
Subclass
Piperazines
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Level 5
Dioxopiperazines
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Level 6
2,5-dioxopiperazines
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Level 7
Thiodioxopiperazines
- Level 8 Epipolythiodioxopiperazines
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Level 7
Thiodioxopiperazines
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Level 6
2,5-dioxopiperazines
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Level 5
Dioxopiperazines
-
Subclass
Piperazines
-
Class
Diazinanes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazinanes
Subclass
Piperazines
Intermediate Tree Nodes
Dioxopiperazines - 2,5-dioxopiperazines - Thiodioxopiperazines
Direct Parent
Epipolythiodioxopiperazines
Alternative Parents
Alpha amino acids and derivatives Phenoxy compounds Phenol ethers N-methylpiperazines Alkyl aryl ethers Dithiazinanes Tertiary carboxylic acid amides Organic disulfides Lactams Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Epipolythiodioxopiperazine - Phenoxy compound - Phenol ether - Alkyl aryl ether - N-alkylpiperazine - N-methylpiperazine - Monocyclic benzene moiety - Dithiazinane - Benzenoid - Tertiary carboxylic acid amide - Carboxamide group - Lactam - Organic disulfide - Carboxylic acid derivative - Ether - Azacycle - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Carbonyl group - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as epipolythiodioxopiperazines. These are compounds containing an epipolythiodioxopiperazine moiety, which consists of a 2,3-dithia-5,7-diazabicyclo[2.2.2]octane-6,8-dione ring system. One distinct characteristics of Epipolythiodioxopiperazines is the presence of unique di- or polysulfide bridges.
External Descriptors
Not available