N-[1-[[9-ethyl-2-(5-fluoranyl-1H-indol-4-yl)-6-morpholin-4-yl-purin-8-yl]methyl]piperidin-4-yl]-N-methyl-methanesulfonamide

Systemtic Name: N-[1-[[9-ethyl-2-(5-fluoranyl-1H-indol-4-yl)-6-morpholin-4-yl-purin-8-yl]methyl]piperidin-4-yl]-N-methyl-methanesulfonamide Openeye Name: N-[1-[[9-ethyl-2-(5-fluoro-1H-indol-4-yl)-6-morpholino-purin-8-yl]methyl]-4-piperidyl]-N-methyl-methanesulfonamide CAS Name: N-[1-[[9-ethyl-2-(5-fluoro-1H-indol-4-yl)-6-(4-morpholinyl)-8-purinyl]methyl]-4-piperidinyl]-N-methylmethanesulfonamide IUPAC Name: N-[1-[[9-ethyl-2-(5-fluoro-1H-indol-4-yl)-6-morpholin-4-ylpurin-8-yl]methyl]piperidin-4-yl]-N-methylmethanesulfonamide Traditional Name: N-[1-[[9-ethyl-2-(5-fluoro-1H-indol-4-yl)-6-morpholino-purin-8-yl]methyl]-4-piperidyl]-N-methyl-methanesulfonamide Formula: C27H35FN8O3S MolecularWeight: 570.682003

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC2=C1N=C(N=C2N3CCOCC3)C4=C(C=CC5=C4C=CN5)F)CN6CCC(CC6)N(C)S(=O)(=O)C

Isomeric SMILES

CCN1C(=NC2=C1N=C(N=C2N3CCOCC3)C4=C(C=CC5=C4C=CN5)F)CN6CCC(CC6)N(C)S(=O)(=O)C

InChI

InChI=1S/C27H35FN8O3S/c1-4-36-22(17-34-11-8-18(9-12-34)33(2)40(3,37)38)30-24-26(35-13-15-39-16-14-35)31-25(32-27(24)36)23-19-7-10-29-21(19)6-5-20(23)28/h5-7,10,18,29H,4,8-9,11-17H2,1-3H3