Compound Identification
SMILES
CC(C)(O)CNC(=O)[C@@H]1CCCN1S(=O)(=O)C1=CN=C2N(C(=O)[C@@](C)(CC3=CC=C(C=C3)C#N)N12)C1=CC(Cl)=CC(Cl)=C1
InChIKey
InChIKey=WJFVJHDCMIWCSF-MUAVYFROSA-N
Formula
C29H30Cl2N6O5S
Mass
645.56
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
-
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 Amphetamines and derivatives Benzonitriles Dichlorobenzenes Pyrrolidinecarboxamides Aryl chlorides N-substituted imidazoles Organosulfonamides Tertiary alcohols Heteroaromatic compounds Sulfonyls Tertiary carboxylic acid amides Lactams Secondary carboxylic acid amides Nitriles Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Proline or derivatives - Alpha-amino acid amide - Amphetamine or derivatives - Benzonitrile - 1,3-dichlorobenzene - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - N-substituted imidazole - Organosulfonic acid amide - Azole - Heteroaromatic compound - Tertiary carboxylic acid amide - Imidazole - Tertiary alcohol - Sulfonyl - Organosulfonic acid or derivatives - Pyrrolidine - Organic sulfonic acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Lactam - Nitrile - Carbonitrile - Azacycle - Organoheterocyclic compound - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - Alcohol - Hydrocarbon derivative - Cyanide - 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