Compound Identification
SMILES
COC1=CC=CC(CNC[C@@H](O)[C@H](CC2=CC=CC=C2)NC(=O)C2=CC(=CC(OC)=C2)C(=O)N(CCO)CC2=NC(C)=CS2)=C1
InChIKey
InChIKey=VRWDDWXKOGTJFQ-IOWSJCHKSA-N
Formula
C34H40N4O6S
Mass
632.78
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylbutylamines
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylbutylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylbutylamines
Alternative Parents
Amphetamines and derivatives Benzamides Anisoles Benzoyl derivatives Benzylamines Methoxybenzenes Phenoxy compounds Phenylmethylamines Alkyl aryl ethers 2,4-disubstituted thiazoles Aralkylamines Heteroaromatic compounds Tertiary carboxylic acid amides Amino acids and derivatives Tertiary amines 1,2-aminoalcohols Secondary alcohols Secondary carboxylic acid amides Dialkylamines Azacyclic compounds Hydrocarbon derivatives Organic oxides Primary alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylbutylamine - Amphetamine or derivatives - Benzamide - Benzoic acid or derivatives - Phenoxy compound - Anisole - Methoxybenzene - Benzoyl - Benzylamine - Phenol ether - Phenylmethylamine - 2,4-disubstituted 1,3-thiazole - Alkyl aryl ether - Aralkylamine - Azole - Heteroaromatic compound - Thiazole - Tertiary carboxylic acid amide - Tertiary amine - Secondary alcohol - Carboxamide group - Secondary carboxylic acid amide - Amino acid or derivatives - 1,2-aminoalcohol - Alkanolamine - Secondary amine - Ether - Secondary aliphatic amine - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Amine - Organic oxygen compound - Alcohol - Primary alcohol - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylbutylamines. These are compounds containing a phenylbutylamine moiety, which consists of a phenyl group substituted at the fourth carbon by an butan-1-amine.
External Descriptors
Not available