Compound Identification
SMILES
CCC1=CC=C(C=C1)S(=O)(=O)NC1C(O)CCC2=C1C=C(C=C2)N(CC1=CN=CC=C1)C(=O)C1CCCN1CC1=CC(Cl)=CC=C1
InChIKey
InChIKey=PBECUPZYWYOMHW-UHFFFAOYSA-N
Formula
C36H39ClN4O4S
Mass
659.24
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Proline and derivatives
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Level 6
Alpha amino acids and derivatives
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Level 5
Amino acids and derivatives
-
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
Proline and derivatives
Alternative Parents
Alpha amino acid amides Tetralins Benzenesulfonamides Benzenesulfonyl compounds Benzylamines Phenylmethylamines Pyrrolidinecarboxamides Chlorobenzenes Aralkylamines Organosulfonamides N-alkylpyrrolidines Aryl chlorides Pyridines and derivatives Heteroaromatic compounds Tertiary carboxylic acid amides Aminosulfonyl compounds Trialkylamines Secondary alcohols Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Proline or derivatives - Alpha-amino acid amide - Benzenesulfonamide - Tetralin - Benzenesulfonyl group - Benzylamine - Phenylmethylamine - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Chlorobenzene - Halobenzene - Aralkylamine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyridine - Benzenoid - Organosulfonic acid amide - N-alkylpyrrolidine - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrrolidine - Aminosulfonyl compound - Tertiary carboxylic acid amide - Sulfonyl - Heteroaromatic compound - Secondary alcohol - Tertiary aliphatic amine - Tertiary amine - Carboxamide group - Organoheterocyclic compound - Azacycle - Alcohol - Organohalogen compound - Hydrocarbon derivative - Organochloride - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as proline and derivatives. These are compounds containing proline or a derivative thereof resulting from reaction of proline at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available