5-fluoranyl-2-methylsulfanyl-1-[1-[[1-(pyridazin-4-ylmethyl)piperidin-4-yl]methyl]piperidin-4-yl]benzimidazole

Systemtic Name: 5-fluoranyl-2-methylsulfanyl-1-[1-[[1-(pyridazin-4-ylmethyl)piperidin-4-yl]methyl]piperidin-4-yl]benzimidazole Openeye Name: 5-fluoro-2-methylsulfanyl-1-[1-[[1-(pyridazin-4-ylmethyl)-4-piperidyl]methyl]-4-piperidyl]benzimidazole CAS Name: 5-fluoro-2-(methylthio)-1-[1-[[1-(4-pyridazinylmethyl)-4-piperidinyl]methyl]-4-piperidinyl]benzimidazole IUPAC Name: 5-fluoro-2-methylsulfanyl-1-[1-[[1-(pyridazin-4-ylmethyl)piperidin-4-yl]methyl]piperidin-4-yl]benzimidazole Traditional Name: 5-fluoro-2-(methylthio)-1-[1-[[1-(pyridazin-4-ylmethyl)-4-piperidyl]methyl]-4-piperidyl]benzimidazole Formula: C24H31FN6S MolecularWeight: 454.606543

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(N1C3CCN(CC3)CC4CCN(CC4)CC5=CN=NC=C5)C=CC(=C2)F

Isomeric SMILES

CSC1=NC2=C(N1C3CCN(CC3)CC4CCN(CC4)CC5=CN=NC=C5)C=CC(=C2)F

InChI

InChI=1S/C24H31FN6S/c1-32-24-28-22-14-20(25)2-3-23(22)31(24)21-7-12-30(13-8-21)16-18-5-10-29(11-6-18)17-19-4-9-26-27-15-19/h2-4,9,14-15,18,21H,5-8,10-13,16-17H2,1H3