Compound Identification
SMILES
Nc1sc(C#Cc2ccccc2)c(CN2CCN(CC2)c2ccc(Cl)c(c2)C(F)(F)F)c1C(=O)c1ccc(Cl)cc1
InChIKey
InChIKey=WEUHMOMVFOBCKU-UHFFFAOYSA-N
Formula
C31H24Cl2F3N3OS
Mass
614.51
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
2-amino-3-benzoylthiophenes Aryl-phenylketones Phenylpiperazines N-arylpiperazines Trifluoromethylbenzenes 3,4,5-trisubstituted-2-aminothiophenes Benzoyl derivatives Dialkylarylamines Thiophene carboxylic acids and derivatives Aniline and substituted anilines Chlorobenzenes Aralkylamines N-alkylpiperazines Aryl chlorides Heteroaromatic compounds Vinylogous amides Trialkylamines Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organofluorides Alkyl fluorides Organopnictogen compounds Primary amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-amino-3-aroyl-4,5-alkylthiophene - 2-amino-3-benzoylthiophene - Aryl-phenylketone - Phenylpiperazine - N-arylpiperazine - Trifluoromethylbenzene - 3,4,5-trisubstituted-2-aminothiophene - Benzoyl - Tertiary aliphatic/aromatic amine - Thiophene carboxylic acid or derivatives - Aryl ketone - Dialkylarylamine - Aniline or substituted anilines - Aralkylamine - Halobenzene - N-alkylpiperazine - Chlorobenzene - Benzenoid - 2-aminothiophene - Aryl halide - 1,4-diazinane - Aryl chloride - Piperazine - Monocyclic benzene moiety - Vinylogous amide - Heteroaromatic compound - Ketone - Tertiary amine - Tertiary aliphatic amine - Azacycle - Organic oxide - Organofluoride - Organochloride - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Primary amine - Alkyl fluoride - Alkyl halide - Amine - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - 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