4-[4-[6-fluoranyl-2-(trifluoromethyl)thioxanthen-9-ylidene]piperidin-1-yl]carbonylcyclohexan-1-one

Systemtic Name: 4-[4-[6-fluoranyl-2-(trifluoromethyl)thioxanthen-9-ylidene]piperidin-1-yl]carbonylcyclohexan-1-one Openeye Name: 4-[4-[6-fluoro-2-(trifluoromethyl)thioxanthen-9-ylidene]piperidine-1-carbonyl]cyclohexanone CAS Name: 4-[[4-[6-fluoro-2-(trifluoromethyl)-9-thioxanthenylidene]-1-piperidinyl]-oxomethyl]-1-cyclohexanone IUPAC Name: 4-[4-[6-fluoro-2-(trifluoromethyl)thioxanthen-9-ylidene]piperidine-1-carbonyl]cyclohexan-1-one Traditional Name: 4-[4-[6-fluoro-2-(trifluoromethyl)thioxanthen-9-ylidene]piperidine-1-carbonyl]cyclohexanone Formula: C26H23F4NO2S MolecularWeight: 489.524933

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)CCC1C(=O)N2CCC(=C3C4=C(C=C(C=C4)F)SC5=C3C=C(C=C5)C(F)(F)F)CC2

Isomeric SMILES

C1CC(=O)CCC1C(=O)N2CCC(=C3C4=C(C=C(C=C4)F)SC5=C3C=C(C=C5)C(F)(F)F)CC2

InChI

InChI=1S/C26H23F4NO2S/c27-18-4-7-20-23(14-18)34-22-8-3-17(26(28,29)30)13-21(22)24(20)15-9-11-31(12-10-15)25(33)16-1-5-19(32)6-2-16/h3-4,7-8,13-14,16H,1-2,5-6,9-12H2