N-[(4-acetamidophenyl)methyl]-2-[bis(fluoranyl)methylsulfanyl]pyridine-3-carboxamide

Systemtic Name: N-[(4-acetamidophenyl)methyl]-2-[bis(fluoranyl)methylsulfanyl]pyridine-3-carboxamide Openeye Name: N-[(4-acetamidophenyl)methyl]-2-(difluoromethylsulfanyl)pyridine-3-carboxamide CAS Name: N-[(4-acetamidophenyl)methyl]-2-(difluoromethylthio)-3-pyridinecarboxamide IUPAC Name: N-[(4-acetamidophenyl)methyl]-2-(difluoromethylsulfanyl)pyridine-3-carboxamide Traditional Name: N-(4-acetamidobenzyl)-2-(difluoromethylthio)nicotinamide Formula: C16H15F2N3O2S MolecularWeight: 351.371006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)CNC(=O)C2=C(N=CC=C2)SC(F)F

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)CNC(=O)C2=C(N=CC=C2)SC(F)F

InChI

InChI=1S/C16H15F2N3O2S/c1-10(22)21-12-6-4-11(5-7-12)9-20-14(23)13-3-2-8-19-15(13)24-16(17)18/h2-8,16H,9H2,1H3,(H,20,23)(H,21,22)