2-[bis(fluoranyl)methylsulfanyl]-N-[(4-piperidin-1-ylcarbonylphenyl)methyl]pyridine-3-carboxamide

Systemtic Name: 2-[bis(fluoranyl)methylsulfanyl]-N-[(4-piperidin-1-ylcarbonylphenyl)methyl]pyridine-3-carboxamide Openeye Name: 2-(difluoromethylsulfanyl)-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]pyridine-3-carboxamide CAS Name: 2-(difluoromethylthio)-N-[[4-[oxo(1-piperidinyl)methyl]phenyl]methyl]-3-pyridinecarboxamide IUPAC Name: 2-(difluoromethylsulfanyl)-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]pyridine-3-carboxamide Traditional Name: 2-(difluoromethylthio)-N-[4-(piperidine-1-carbonyl)benzyl]nicotinamide Formula: C20H21F2N3O2S MolecularWeight: 405.461446

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC=C(C=C2)CNC(=O)C3=C(N=CC=C3)SC(F)F

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC=C(C=C2)CNC(=O)C3=C(N=CC=C3)SC(F)F

InChI

InChI=1S/C20H21F2N3O2S/c21-20(22)28-18-16(5-4-10-23-18)17(26)24-13-14-6-8-15(9-7-14)19(27)25-11-2-1-3-12-25/h4-10,20H,1-3,11-13H2,(H,24,26)