Compound Identification
SMILES
CC(C)CN(C[C@@H](O)[C@H](CC1=CC=CC=C1)NC(=O)O[C@H]1CO[C@H]2OCC[C@@H]12)S(=O)(=O)C1=CC2=C(C=C1)N=C(S2)N(C)CCCN1CCCC1
InChIKey
InChIKey=QOOZUVAZLBMAPP-RAJOBRQESA-N
Formula
C36H51N5O7S2
Mass
729.95
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 Benzothiazoles Dialkylarylamines Furofurans 2-amino-1,3-thiazoles Organosulfonamides N-alkylpyrrolidines Aminosulfonyl compounds Tetrahydrofurans Carbamate esters Heteroaromatic compounds Trialkylamines Secondary alcohols Organic carbonic acids and derivatives Oxacyclic compounds Azacyclic compounds Acetals Organopnictogen compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylbutylamine - Amphetamine or derivatives - 1,3-benzothiazole - Furofuran - Dialkylarylamine - Organosulfonic acid amide - N-alkylpyrrolidine - 1,3-thiazol-2-amine - Azole - Pyrrolidine - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Tetrahydrofuran - Thiazole - Carbamic acid ester - Aminosulfonyl compound - Heteroaromatic compound - Carbonic acid derivative - Secondary alcohol - Tertiary aliphatic amine - Tertiary amine - Azacycle - Oxacycle - Organoheterocyclic compound - Acetal - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organosulfur compound - Organic oxide - Organic oxygen compound - Alcohol - Carbonyl group - Organopnictogen compound - Amine - Organic nitrogen compound - Aromatic heteropolycyclic 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