Compound Identification
SMILES
COC1=CC=C(C=C1)N=C1SC(=CC2=CC(C)=C(O)C(C)=C2)C(=O)N1CCC1=CNC2=CC=CC=C12
InChIKey
InChIKey=MSPLTHZALVMBHB-UHFFFAOYSA-N
Formula
C29H27N3O3S
Mass
497.61
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
Methoxyanilines Anisoles m-Xylenes Methoxybenzenes Ortho cresols Phenoxy compounds Alkyl aryl ethers Substituted pyrroles Heteroaromatic compounds Thiazolidines Isothioureas Azacyclic compounds Carboxylic acids and derivatives Propargyl-type 1,3-dipolar organic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-alkylindole - Methoxyaniline - Phenoxy compound - Methoxybenzene - Phenol ether - O-cresol - Xylene - M-xylene - Anisole - Alkyl aryl ether - Phenol - Benzenoid - Monocyclic benzene moiety - Substituted pyrrole - Thiazolidine - Heteroaromatic compound - Pyrrole - Isothiourea - Organic 1,3-dipolar compound - Azacycle - Ether - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Organic oxide - Organic oxygen compound - 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