2-[4-[2-[bis(fluoranyl)methylsulfanyl]pyridin-3-yl]carbonylpiperazin-1-yl]-N-butyl-ethanamide

Systemtic Name: 2-[4-[2-[bis(fluoranyl)methylsulfanyl]pyridin-3-yl]carbonylpiperazin-1-yl]-N-butyl-ethanamide Openeye Name: N-butyl-2-[4-[2-(difluoromethylsulfanyl)pyridine-3-carbonyl]piperazin-1-yl]acetamide CAS Name: N-butyl-2-[4-[[2-(difluoromethylthio)-3-pyridinyl]-oxomethyl]-1-piperazinyl]acetamide IUPAC Name: N-butyl-2-[4-[2-(difluoromethylsulfanyl)pyridine-3-carbonyl]piperazin-1-yl]acetamide Traditional Name: N-butyl-2-[4-[2-(difluoromethylthio)nicotinoyl]piperazino]acetamide Formula: C17H24F2N4O2S MolecularWeight: 386.459866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN1CCN(CC1)C(=O)C2=C(N=CC=C2)SC(F)F

Isomeric SMILES

CCCCNC(=O)CN1CCN(CC1)C(=O)C2=C(N=CC=C2)SC(F)F

InChI

InChI=1S/C17H24F2N4O2S/c1-2-3-6-20-14(24)12-22-8-10-23(11-9-22)16(25)13-5-4-7-21-15(13)26-17(18)19/h4-5,7,17H,2-3,6,8-12H2,1H3,(H,20,24)