Compound Identification
SMILES
CC1=CC=C(S[C@]2(CC(=O)N(CC3=CC=C(Cl)C=C3)[C@H]2C2=CNC3=C2C=CC(Cl)=C3)C(=O)N2CCN(CC2)C(=O)NCCCCO)C=C1
InChIKey
InChIKey=NETQESYAKWLRCD-JUKUECOXSA-N
Formula
C36H39Cl2N5O4S
Mass
708.7
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Indoles and derivatives
-
Subclass
Indoles
- Level 5 3-alkylindoles
-
Subclass
Indoles
-
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
Piperazine carboxamides Thiophenol ethers Pyrrolidinecarboxamides Toluenes Alkylarylthioethers Chlorobenzenes Substituted pyrroles Pyrrolidine-2-ones Aryl chlorides N-alkylpyrrolidines Tertiary carboxylic acid amides Heteroaromatic compounds Ureas Tertiary amines Amino acids and derivatives Lactams Alkanolamines Sulfenyl compounds Azacyclic compounds Primary alcohols Organochlorides Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-alkylindole - Piperazine-1-carboxamide - Aryl thioether - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-3-carboxamide - Thiophenol ether - Chlorobenzene - Halobenzene - Toluene - Alkylarylthioether - Aryl chloride - Aryl halide - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Pyrrolidone - 2-pyrrolidone - Substituted pyrrole - Benzenoid - N-alkylpyrrolidine - Tertiary carboxylic acid amide - Pyrrolidine - Heteroaromatic compound - Pyrrole - Carboxamide group - Urea - Tertiary amine - Amino acid or derivatives - Lactam - Thioether - Alkanolamine - Carboxylic acid derivative - Sulfenyl compound - Azacycle - Hydrocarbon derivative - Organic oxygen compound - Organohalogen compound - Organic nitrogen compound - Organochloride - Organonitrogen compound - Amine - Carbonyl group - Alcohol - Organooxygen compound - Organosulfur compound - Organic oxide - Primary alcohol - 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