Compound Identification
SMILES
[Na+].CC1(C)C(=CC=C2CCCC(C=CC3=[N+](CCCCS([O-])(=O)=O)C4=CC=CC=C4C3(C)C)=C2SC2=CC=C(C=C2)N=C=S)N(CCCCS(O)(=O)=O)C2=CC=CC=C12
InChIKey
InChIKey=URQBXUCJHTXMKS-UHFFFAOYSA-N
Formula
C45H51N3NaO6S4
Mass
881.15
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Indoles and derivatives
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Subclass
Indoles
- Level 5 3-alkylindoles
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Subclass
Indoles
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Class
Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Indoles
Intermediate Tree Nodes
Not available
Direct Parent
3-alkylindoles
Alternative Parents
Tertiary alkylarylamines Aryl thioethers Benzene and substituted derivatives Sulfonyls Organosulfonic acids Alkanesulfonic acids Thioenol ethers Isothiocyanates Sulfenyl compounds Enamines Azacyclic compounds Organic sodium salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-alkylindole - Aryl thioether - Tertiary aliphatic/aromatic amine - Monocyclic benzene moiety - Benzenoid - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Alkanesulfonic acid - Isothiocyanate - Tertiary amine - Thioenolether - Enamine - Azacycle - Organic alkali metal salt - Sulfenyl compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organonitrogen compound - Organic oxygen compound - Organic sodium salt - Organic salt - Amine - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 3-alkylindoles. These are compounds containing an indole moiety that carries an alkyl chain at the 3-position.
External Descriptors
Not available