2-methylsulfanyl-N-[phenyl-(1-pyrrolidin-1-ylcyclobutyl)methyl]-6-(trifluoromethyl)benzamide

Systemtic Name: 2-methylsulfanyl-N-[phenyl-(1-pyrrolidin-1-ylcyclobutyl)methyl]-6-(trifluoromethyl)benzamide Openeye Name: 2-methylsulfanyl-N-[phenyl-(1-pyrrolidin-1-ylcyclobutyl)methyl]-6-(trifluoromethyl)benzamide CAS Name: 2-(methylthio)-N-[phenyl-[1-(1-pyrrolidinyl)cyclobutyl]methyl]-6-(trifluoromethyl)benzamide IUPAC Name: 2-methylsulfanyl-N-[phenyl-(1-pyrrolidin-1-ylcyclobutyl)methyl]-6-(trifluoromethyl)benzamide Traditional Name: 2-(methylthio)-N-[phenyl-(1-pyrrolidinocyclobutyl)methyl]-6-(trifluoromethyl)benzamide Formula: C24H27F3N2OS MolecularWeight: 448.54419

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1C(=O)NC(C2=CC=CC=C2)C3(CCC3)N4CCCC4)C(F)(F)F

Isomeric SMILES

CSC1=CC=CC(=C1C(=O)NC(C2=CC=CC=C2)C3(CCC3)N4CCCC4)C(F)(F)F

InChI

InChI=1S/C24H27F3N2OS/c1-31-19-12-7-11-18(24(25,26)27)20(19)22(30)28-21(17-9-3-2-4-10-17)23(13-8-14-23)29-15-5-6-16-29/h2-4,7,9-12,21H,5-6,8,13-16H2,1H3,(H,28,30)