4-[bis(fluoranyl)methylsulfanyl]-N-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]benzamide

Systemtic Name: 4-[bis(fluoranyl)methylsulfanyl]-N-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]benzamide Openeye Name: 4-(difluoromethylsulfanyl)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]benzamide CAS Name: 4-(difluoromethylthio)-N-[[4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl]benzamide IUPAC Name: 4-(difluoromethylsulfanyl)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]benzamide Traditional Name: 4-(difluoromethylthio)-N-[4-(pyrrolidine-1-carbonyl)benzyl]benzamide Formula: C20H20F2N2O2S MolecularWeight: 390.446806

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=C(C=C2)CNC(=O)C3=CC=C(C=C3)SC(F)F

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=C(C=C2)CNC(=O)C3=CC=C(C=C3)SC(F)F

InChI

InChI=1S/C20H20F2N2O2S/c21-20(22)27-17-9-7-15(8-10-17)18(25)23-13-14-3-5-16(6-4-14)19(26)24-11-1-2-12-24/h3-10,20H,1-2,11-13H2,(H,23,25)