5-[[4-[[4-(5-fluoranyl-2-methylsulfanyl-benzimidazol-1-yl)piperidin-1-yl]methyl]piperidin-1-yl]methyl]pyrimidin-2-amine

Systemtic Name: 5-[[4-[[4-(5-fluoranyl-2-methylsulfanyl-benzimidazol-1-yl)piperidin-1-yl]methyl]piperidin-1-yl]methyl]pyrimidin-2-amine Openeye Name: 5-[[4-[[4-(5-fluoro-2-methylsulfanyl-benzimidazol-1-yl)-1-piperidyl]methyl]-1-piperidyl]methyl]pyrimidin-2-amine CAS Name: 5-[[4-[[4-[5-fluoro-2-(methylthio)-1-benzimidazolyl]-1-piperidinyl]methyl]-1-piperidinyl]methyl]-2-pyrimidinamine IUPAC Name: 5-[[4-[[4-(5-fluoro-2-methylsulfanylbenzimidazol-1-yl)piperidin-1-yl]methyl]piperidin-1-yl]methyl]pyrimidin-2-amine Traditional Name: [5-[[4-[[4-[5-fluoro-2-(methylthio)benzimidazol-1-yl]piperidino]methyl]piperidino]methyl]pyrimidin-2-yl]amine Formula: C24H32FN7S MolecularWeight: 469.621183

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H32FN7S/c1-33-24-29-21-12-19(25)2-3-22(21)32(24)20-6-10-31(11-7-20)15-17-4-8-30(9-5-17)16-18-13-27-23(26)28-14-18/h2-3,12-14,17,20H,4-11,15-16H2,1H3,(H2,26,27,28)