Compound Identification
SMILES
[O-][N+](=O)C1=CC(C(=O)NC(C(SC2=CC=CC=C2)C2=CC=C(C=C2)N(CCC#N)CCC#N)C(=O)SC2=CC=CC=C2)=C(Cl)C=C1
InChIKey
InChIKey=UVCFIPGIXHLURX-UHFFFAOYSA-N
Formula
C34H28ClN5O4S2
Mass
670.2
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Level 5
Amino acids and derivatives
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Level 6
Alpha amino acids and derivatives
- Level 7 Phenylalanine and derivatives
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Level 6
Alpha amino acids and derivatives
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Level 5
Amino acids and derivatives
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Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Amino acids, peptides, and analogues
Intermediate Tree Nodes
Amino acids and derivatives - Alpha amino acids and derivatives
Direct Parent
Phenylalanine and derivatives
Alternative Parents
Hippuric acids and derivatives N-acyl-alpha amino acids and derivatives 2-halobenzoic acids and derivatives Thiophenol esters Nitrobenzenes Thiophenol ethers Aniline and substituted anilines Benzoyl derivatives Dialkylarylamines Nitroaromatic compounds Alkylarylthioethers Chlorobenzenes Aryl chlorides Vinylogous halides Thioesters Secondary carboxylic acid amides Carbothioic S-esters Organic oxoazanium compounds Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Nitriles Organic zwitterions Organochlorides Carbonyl compounds Organopnictogen compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenylalanine or derivatives - Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Nitrobenzene - Thiophenol ester - Aryl thioether - Nitroaromatic compound - Benzoyl - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Thiophenol ether - Chlorobenzene - Halobenzene - Alkylarylthioether - Benzenoid - Aryl halide - Monocyclic benzene moiety - Aryl chloride - Vinylogous halide - Carboxamide group - C-nitro compound - Organic nitro compound - Secondary carboxylic acid amide - Carbothioic s-ester - Tertiary amine - Thiocarboxylic acid ester - Thioether - Thiocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carbonitrile - Nitrile - Sulfenyl compound - Organic oxoazanium - Hydrocarbon derivative - Organic oxide - Amine - Organic nitrogen compound - Organic oxygen compound - Organosulfur compound - Organopnictogen compound - Organic zwitterion - Organohalogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylalanine and derivatives. These are compounds containing phenylalanine or a derivative thereof resulting from reaction of phenylalanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available