Compound Identification
SMILES
CC[C@@H](NC(=O)N1CC(NOC2=CC=CC=C2)=NCC(CC2=C(OC)C=CC(Cl)=C2)C1=O)C1=CC=C(S1)C(O)=O
InChIKey
InChIKey=QZOIIYRRFFWCBZ-BDPMCISCSA-N
Formula
C28H29ClN4O6S
Mass
585.07
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
-
Class
Thiophenes
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Subclass
Thiophene carboxylic acids and derivatives
- Level 5 Thiophene carboxylic acids
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Subclass
Thiophene carboxylic acids and derivatives
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Class
Thiophenes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thiophenes
Subclass
Thiophene carboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Thiophene carboxylic acids
Alternative Parents
Phenoxy compounds Anisoles Methoxybenzenes 2,5-disubstituted thiophenes Alkyl aryl ethers N-acyl ureas Chlorobenzenes Aryl chlorides Imidolactams Dicarboximides Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Amidines Carbonyl compounds Organic oxides Organochlorides Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenoxy compound - Anisole - Phenol ether - Thiophene carboxylic acid - Methoxybenzene - Alkyl aryl ether - N-acyl urea - Ureide - Chlorobenzene - 2,5-disubstituted thiophene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Imidolactam - Benzenoid - Heteroaromatic compound - Dicarboximide - Carbonic acid derivative - Urea - Amidine - Carboxylic acid derivative - Carboxylic acid - Azacycle - Organic 1,3-dipolar compound - Ether - Propargyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Organonitrogen compound - Organohalogen compound - Organochloride - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as thiophene carboxylic acids. These are compounds containing a thiophene ring which bears a carboxylic acid group.
External Descriptors
Not available