1-[1-[(3R)-3-[3,5-bis(fluoranyl)phenyl]-3-(1-methylsulfonylpiperidin-4-yl)propyl]piperidin-4-yl]-5-methylsulfonyl-benzimidazole

Systemtic Name: 1-[1-[(3R)-3-[3,5-bis(fluoranyl)phenyl]-3-(1-methylsulfonylpiperidin-4-yl)propyl]piperidin-4-yl]-5-methylsulfonyl-benzimidazole Openeye Name: 1-[1-[(3R)-3-(3,5-difluorophenyl)-3-(1-methylsulfonyl-4-piperidyl)propyl]-4-piperidyl]-5-methylsulfonyl-benzimidazole CAS Name: 1-[1-[(3R)-3-(3,5-difluorophenyl)-3-(1-methylsulfonyl-4-piperidinyl)propyl]-4-piperidinyl]-5-methylsulfonylbenzimidazole IUPAC Name: 1-[1-[(3R)-3-(3,5-difluorophenyl)-3-(1-methylsulfonylpiperidin-4-yl)propyl]piperidin-4-yl]-5-methylsulfonylbenzimidazole Traditional Name: 1-[1-[(3R)-3-(3,5-difluorophenyl)-3-(1-mesyl-4-piperidyl)propyl]-4-piperidyl]-5-mesyl-benzimidazole Formula: C28H36F2N4O4S2 MolecularWeight: 594.736646

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N(C=N2)C3CCN(CC3)CCC(C4CCN(CC4)S(=O)(=O)C)C5=CC(=CC(=C5)F)F

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N(C=N2)C3CCN(CC3)CC[C@H](C4CCN(CC4)S(=O)(=O)C)C5=CC(=CC(=C5)F)F

InChI

InChI=1S/C28H36F2N4O4S2/c1-39(35,36)25-3-4-28-27(18-25)31-19-34(28)24-7-10-32(11-8-24)12-9-26(21-15-22(29)17-23(30)16-21)20-5-13-33(14-6-20)40(2,37)38/h3-4,15-20,24,26H,5-14H2,1-2H3/t26-/m1/s1