Compound Identification
SMILES
C1=CC=NC=C1.C\C=C\B1OB(OB(O1)\C=C/C)\C=C\C.CC(C)=CC1=CC(=CC(=C1)N(C1=CC=CC=C1)S(C)(=O)=O)C(=O)N[C@@H](CC1=CC=CC=C1)[C@H](O)CNCC1=CC(=CC=C1)C(F)(F)F
InChIKey
InChIKey=CFMKAVSKHWKBNT-JXUMCLOXSA-N
Formula
C50H58B3F3N4O7S
Mass
948.52
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
Trifluoromethylbenzenes Sulfanilides Amphetamines and derivatives Benzamides Benzylamines Benzoyl derivatives Phenylmethylamines Organoboroxines Aralkylamines Organosulfonamides Organic sulfonamides Pyridines and derivatives Aminosulfonyl compounds Heteroaromatic compounds Amino acids and derivatives Secondary alcohols Secondary carboxylic acid amides 1,2-aminoalcohols Boronic acid derivatives Oxacyclic compounds Organic metalloid salts Azacyclic compounds Dialkylamines Organic oxides Alkyl fluorides Organometalloid compounds Hydrocarbon derivatives Organofluorides
Molecular Framework
Not available
Substituents
Phenylbutylamine - Amphetamine or derivatives - Trifluoromethylbenzene - Sulfanilide - Benzamide - Benzoic acid or derivatives - Benzoyl - Benzylamine - Phenylmethylamine - Aralkylamine - Organoboroxine - Pyridine - Organosulfonic acid amide - Organic sulfonic acid amide - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Carboxamide group - Boronic acid derivative - 1,2-aminoalcohol - Amino acid or derivatives - Secondary alcohol - Secondary carboxylic acid amide - Organic metalloid salt - Azacycle - Oxacycle - Organoheterocyclic compound - Secondary aliphatic amine - Secondary amine - Carboxylic acid derivative - Alkyl fluoride - Organohalogen compound - Organic metalloid moeity - Organofluoride - Alcohol - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Amine - Alkyl halide - Organosulfur compound - Hydrocarbon derivative - 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