Compound Identification
SMILES
CN1C2=C(C=C(Cl)C=C2)C(CCC(=S)N2CCN(CC3=CC=CC=C3)CC2)=C1C1=CC=C(Cl)C=C1
InChIKey
InChIKey=SJORLPJWMDCYCI-UHFFFAOYSA-N
Formula
C29H29Cl2N3S
Mass
522.53
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
Tryptamines and derivatives Phenylpyrroles 3-alkylindoles N-alkylindoles Benzylamines Phenylmethylamines Aralkylamines Chlorobenzenes N-alkylpiperazines Aryl chlorides N-methylpyrroles Heteroaromatic compounds Thioamides Trialkylamines Azacyclic compounds Thiocarboxylic acid amides Organopnictogen compounds Hydrocarbon derivatives Thiocarbonyl compounds Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylindole - Triptan - 2-phenylpyrrole - N-alkylindole - 3-alkylindole - Benzylamine - Phenylmethylamine - Chlorobenzene - Halobenzene - Aralkylamine - N-alkylpiperazine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - 1,4-diazinane - N-methylpyrrole - Piperazine - Substituted pyrrole - Benzenoid - Heteroaromatic compound - Thioamide - Pyrrole - Tertiary aliphatic amine - Tertiary amine - Azacycle - Thiocarboxylic acid amide - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organohalogen compound - Organopnictogen compound - Organochloride - Organonitrogen compound - Thiocarbonyl group - Organosulfur 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