Compound Identification
SMILES
[O-]S([O-])(=O)=O.CSC1=CC=C(CN2CCN(CC2)C(N)=N)C=C1.CSC1=CC=C(CN2CCN(CC2)C(N)=N)C=C1
InChIKey
InChIKey=LISFQIDRQUYPGF-UHFFFAOYSA-L
Formula
C26H40N8O4S3
Mass
624.84
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
Thiophenol ethers Benzylamines Alkylarylthioethers Aralkylamines N-alkylpiperazines Organic sulfate salts Organic sulfuric acids and derivatives Trialkylamines Guanidines Carboximidamides Azacyclic compounds Sulfenyl compounds Imines Hydrocarbon derivatives Organopnictogen compounds Organic oxides Organic anions
Molecular Framework
Not available
Substituents
Benzylamine - Aryl thioether - Phenylmethylamine - Thiophenol ether - Aralkylamine - Alkylarylthioether - N-alkylpiperazine - 1,4-diazinane - Piperazine - Organic sulfate salt - Organic sulfuric acid or derivatives - Guanidine - Tertiary amine - Tertiary aliphatic amine - Azacycle - Organoheterocyclic compound - Thioether - Sulfenyl compound - Carboximidamide - Amine - Hydrocarbon derivative - Organosulfur compound - Organonitrogen compound - Organic oxide - Imine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic anion - 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