2-[4-[[2-(5-fluoranyl-1H-indol-4-yl)-6-morpholin-4-yl-7H-purin-8-yl]methyl]piperazin-1-yl]-2-methyl-propanamide

Systemtic Name: 2-[4-[[2-(5-fluoranyl-1H-indol-4-yl)-6-morpholin-4-yl-7H-purin-8-yl]methyl]piperazin-1-yl]-2-methyl-propanamide Openeye Name: 2-[4-[[2-(5-fluoro-1H-indol-4-yl)-6-morpholino-7H-purin-8-yl]methyl]piperazin-1-yl]-2-methyl-propanamide CAS Name: 2-[4-[[2-(5-fluoro-1H-indol-4-yl)-6-(4-morpholinyl)-7H-purin-8-yl]methyl]-1-piperazinyl]-2-methylpropanamide IUPAC Name: 2-[4-[[2-(5-fluoro-1H-indol-4-yl)-6-morpholin-4-yl-7H-purin-8-yl]methyl]piperazin-1-yl]-2-methylpropanamide Traditional Name: 2-[4-[[2-(5-fluoro-1H-indol-4-yl)-6-morpholino-7H-purin-8-yl]methyl]piperazino]-2-methyl-propionamide Formula: C26H32FN9O2 MolecularWeight: 521.589783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)N)N1CCN(CC1)CC2=NC3=C(N2)C(=NC(=N3)C4=C(C=CC5=C4C=CN5)F)N6CCOCC6

Isomeric SMILES

CC(C)(C(=O)N)N1CCN(CC1)CC2=NC3=C(N2)C(=NC(=N3)C4=C(C=CC5=C4C=CN5)F)N6CCOCC6

InChI

InChI=1S/C26H32FN9O2/c1-26(2,25(28)37)36-9-7-34(8-10-36)15-19-30-21-23(31-19)32-22(33-24(21)35-11-13-38-14-12-35)20-16-5-6-29-18(16)4-3-17(20)27/h3-6,29H,7-15H2,1-2H3,(H2,28,37)(H,30,31,32,33)