Compound Identification
SMILES
CC(=O)N1C=C(CN2CCC(CC2)C2=NC(=CS2)C2=CC(=C(Cl)C=C2)[N+]([O-])=O)C2=CC=CC=C12
InChIKey
InChIKey=JWQMJMUMVWAXLC-UHFFFAOYSA-N
Formula
C25H23ClN4O3S
Mass
494.99
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
Nitrobenzenes Nitroaromatic compounds 2,4-disubstituted thiazoles Aralkylamines Chlorobenzenes Substituted pyrroles Piperidines Aryl chlorides Acetamides Heteroaromatic compounds Trialkylamines Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Organooxygen compounds Hydrocarbon derivatives Organic oxides Organic salts Organochlorides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-alkylindole - Nitrobenzene - Nitroaromatic compound - 2,4-disubstituted 1,3-thiazole - Chlorobenzene - Aralkylamine - Halobenzene - Aryl chloride - Aryl halide - Substituted pyrrole - Monocyclic benzene moiety - Benzenoid - Piperidine - Pyrrole - Acetamide - Heteroaromatic compound - Azole - Thiazole - Organic nitro compound - C-nitro compound - Tertiary amine - Tertiary aliphatic amine - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Organic 1,3-dipolar compound - Organic oxoazanium - Organic oxygen compound - Organooxygen compound - Organohalogen compound - Organochloride - Amine - Organic salt - Organic nitrogen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - 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