3-[[2-[bis(fluoranyl)methoxy]phenyl]methylidene]-N-phenyl-2-piperidin-1-yl-cyclopentene-1-carbothioamide

Systemtic Name: 3-[[2-[bis(fluoranyl)methoxy]phenyl]methylidene]-N-phenyl-2-piperidin-1-yl-cyclopentene-1-carbothioamide Openeye Name: 3-[[2-(difluoromethoxy)phenyl]methylene]-N-phenyl-2-(1-piperidyl)cyclopentene-1-carbothioamide CAS Name: 3-[[2-(difluoromethoxy)phenyl]methylidene]-N-phenyl-2-(1-piperidinyl)-1-cyclopentenecarbothioamide IUPAC Name: 3-[[2-(difluoromethoxy)phenyl]methylidene]-N-phenyl-2-piperidin-1-ylcyclopentene-1-carbothioamide Traditional Name: 3-[2-(difluoromethoxy)benzylidene]-N-phenyl-2-piperidino-cyclopentene-1-carbothioamide Formula: C25H26F2N2OS MolecularWeight: 440.548546

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(CCC2=CC3=CC=CC=C3OC(F)F)C(=S)NC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C2=C(CCC2=CC3=CC=CC=C3OC(F)F)C(=S)NC4=CC=CC=C4

InChI

InChI=1S/C25H26F2N2OS/c26-25(27)30-22-12-6-5-9-18(22)17-19-13-14-21(23(19)29-15-7-2-8-16-29)24(31)28-20-10-3-1-4-11-20/h1,3-6,9-12,17,25H,2,7-8,13-16H2,(H,28,31)