Compound Identification
SMILES
CC1=NC2=C(C(C)=C1)C(OCC1=C(Cl)C=CC(=C1Cl)S(=O)(=O)N1CCC[C@H]1C(=O)NCCCNC(=O)C1=CC=C(CN)C=C1)=CC=C2
InChIKey
InChIKey=WJDZCGOJEGNRSK-NDEPHWFRSA-N
Formula
C34H37Cl2N5O5S
Mass
698.66
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 Quinolines and derivatives Benzenesulfonamides Benzamides Benzenesulfonyl compounds Pyrrolidinecarboxamides Phenylmethylamines Phenol ethers Benzoyl derivatives Benzylamines Dichlorobenzenes Alkyl aryl ethers Aralkylamines Methylpyridines Organosulfonamides Aryl chlorides Sulfonyls Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Hydrocarbon derivatives Monoalkylamines Organic oxides Organochlorides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Proline or derivatives - Alpha-amino acid amide - Quinoline - Benzenesulfonamide - Benzoic acid or derivatives - Benzenesulfonyl group - Benzamide - Phenol ether - Phenylmethylamine - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - 1,3-dichlorobenzene - Benzylamine - Benzoyl - Halobenzene - Chlorobenzene - Alkyl aryl ether - Methylpyridine - Aralkylamine - Pyridine - Organosulfonic acid amide - Aryl chloride - Benzenoid - Monocyclic benzene moiety - Aryl halide - Heteroaromatic compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrrolidine - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Ether - Organosulfur compound - Organic oxide - Carbonyl group - Amine - Organic oxygen compound - Primary amine - Primary aliphatic amine - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - 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