Compound Identification
SMILES
COC1=CC2=C(C=C1C#N)C(CCCC(=O)NS(C)(=O)=O)=C(N2)C1=CC=C(F)C=C1
InChIKey
InChIKey=FIOACYLNJGQQFQ-UHFFFAOYSA-N
Formula
C21H20FN3O4S
Mass
429.47
Taxonomic Classification
Taxonomy Tree
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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 2-phenylindoles
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Subclass
Indoles
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Class
Indoles and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Indoles
Intermediate Tree Nodes
Not available
Direct Parent
2-phenylindoles
Alternative Parents
Phenylpyrroles 3-alkylindoles Anisoles Alkyl aryl ethers Fluorobenzenes Aryl fluorides Heteroaromatic compounds Organosulfonic acids and derivatives Aminosulfonyl compounds Nitriles Carboxylic acids and derivatives Azacyclic compounds Carbonyl compounds Organic oxides Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylindole - 2-phenylpyrrole - 3-alkylindole - Anisole - Phenol ether - Fluorobenzene - Alkyl aryl ether - Halobenzene - Aryl fluoride - Benzenoid - Aryl halide - Monocyclic benzene moiety - Substituted pyrrole - Heteroaromatic compound - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrrole - Azacycle - Carboxylic acid derivative - Ether - Carbonitrile - Nitrile - Organic oxide - Organosulfur compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Cyanide - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2-phenylindoles. These are indoles substituted at the 2-position with a phenyl group.
External Descriptors
Not available