Compound Identification
SMILES
C[C@@H](SC1=NN=C(O1)C1=CC(Cl)=CC=C1)C(=O)N1CCN(CC2=CC=CC=C2)CC1
InChIKey
InChIKey=KDZUDGMBZCNXNA-MRXNPFEDSA-N
Formula
C22H23ClN4O2S
Mass
442.96
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylmethylamines
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylmethylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylmethylamines
Alternative Parents
Benzylamines Alkylarylthioethers Aralkylamines Chlorobenzenes N-alkylpiperazines Aryl chlorides 1,3,4-oxadiazoles Tertiary carboxylic acid amides Heteroaromatic compounds Trialkylamines Amino acids and derivatives Oxacyclic compounds Azacyclic compounds Sulfenyl compounds Organochlorides Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl thioether - Benzylamine - Phenylmethylamine - Chlorobenzene - Halobenzene - Aralkylamine - Alkylarylthioether - N-alkylpiperazine - Aryl chloride - Aryl halide - 1,4-diazinane - Piperazine - 1,3,4-oxadiazole - Azole - Heteroaromatic compound - Oxadiazole - Tertiary carboxylic acid amide - Tertiary aliphatic amine - Tertiary amine - Carboxamide group - Amino acid or derivatives - Organoheterocyclic compound - Azacycle - Sulfenyl compound - Thioether - Carboxylic acid derivative - Oxacycle - Organosulfur compound - Hydrocarbon derivative - Organohalogen compound - Organochloride - Carbonyl group - Organic oxide - Amine - Organic oxygen compound - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylmethylamines. These are compounds containing a phenylmethtylamine moiety, which consists of a phenyl group substituted by an methanamine.
External Descriptors
Not available