Compound Identification
SMILES
Nc1sc(C#Cc2ccccc2)c(CN2CCN(CC2)c2ccc(Cl)c(Cl)c2)c1C(=O)c1ccc(Cl)cc1
InChIKey
InChIKey=LJOWIAWJDNKEIE-UHFFFAOYSA-N
Formula
C30H24Cl3N3OS
Mass
580.95
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Thiophenes
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Subclass
3-aroylthiophenes
- Level 5 2-amino-3-aroylthiophenes
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Subclass
3-aroylthiophenes
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Class
Thiophenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thiophenes
Subclass
3-aroylthiophenes
Intermediate Tree Nodes
2-amino-3-aroylthiophenes
Direct Parent
2-amino-3-aroyl-4,5-alkylthiophenes
Alternative Parents
Aryl-phenylketones 2-amino-3-benzoylthiophenes N-arylpiperazines Phenylpiperazines 3,4,5-trisubstituted-2-aminothiophenes Aniline and substituted anilines Dichlorobenzenes Dialkylarylamines Benzoyl derivatives Thiophene carboxylic acids and derivatives Aralkylamines N-alkylpiperazines Aryl chlorides Vinylogous amides Heteroaromatic compounds Trialkylamines Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organopnictogen compounds Primary amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-amino-3-aroyl-4,5-alkylthiophene - Aryl-phenylketone - 2-amino-3-benzoylthiophene - Phenylpiperazine - N-arylpiperazine - 3,4,5-trisubstituted-2-aminothiophene - Tertiary aliphatic/aromatic amine - Thiophene carboxylic acid or derivatives - Benzoyl - 1,2-dichlorobenzene - Aniline or substituted anilines - Dialkylarylamine - Aryl ketone - Halobenzene - Chlorobenzene - N-alkylpiperazine - Aralkylamine - Aryl halide - 1,4-diazinane - Aryl chloride - Monocyclic benzene moiety - 2-aminothiophene - Benzenoid - Piperazine - Heteroaromatic compound - Vinylogous amide - Tertiary aliphatic amine - Tertiary amine - Ketone - Azacycle - Organochloride - Organohalogen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Primary amine - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 2-amino-3-aroyl-4,5-alkylthiophenes. These are 3-aroylthiophenes which are substituted at the 2-position by an amine group and the 4-, and 5-position by an alkyl group.
External Descriptors
Not available