Compound Identification
SMILES
CSC1=C(C(=O)CCN2CCN(CC3=CC=CC=C3)CC2)C(C)=C(S1)C#N
InChIKey
InChIKey=UCIZMLZDVSZYNX-UHFFFAOYSA-N
Formula
C21H25N3OS2
Mass
399.57
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 Aryl alkyl ketones N-alkylpiperazines Aralkylamines Alkylarylthioethers Vinylogous thioesters Beta-amino ketones Thiophenes Heteroaromatic compounds Trialkylamines Sulfenyl compounds Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzylamine - Aryl thioether - Phenylmethylamine - Aryl alkyl ketone - Aryl ketone - Aralkylamine - N-alkylpiperazine - Alkylarylthioether - Beta-aminoketone - 1,4-diazinane - Piperazine - Vinylogous thioester - Heteroaromatic compound - Thiophene - Ketone - Tertiary amine - Tertiary aliphatic amine - Azacycle - Thioether - Nitrile - Carbonitrile - Sulfenyl compound - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Amine - Cyanide - Organic oxygen compound - Organic nitrogen 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