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

Systemtic Name: 1-[1-[[9-ethyl-2-(5-fluoranyl-1H-indol-4-yl)-6-morpholin-4-yl-purin-8-yl]methyl]piperidin-4-yl]pyrrolidin-2-one Openeye Name: 1-[1-[[9-ethyl-2-(5-fluoro-1H-indol-4-yl)-6-morpholino-purin-8-yl]methyl]-4-piperidyl]pyrrolidin-2-one CAS Name: 1-[1-[[9-ethyl-2-(5-fluoro-1H-indol-4-yl)-6-(4-morpholinyl)-8-purinyl]methyl]-4-piperidinyl]-2-pyrrolidinone IUPAC Name: 1-[1-[[9-ethyl-2-(5-fluoro-1H-indol-4-yl)-6-morpholin-4-ylpurin-8-yl]methyl]piperidin-4-yl]pyrrolidin-2-one Traditional Name: 1-[1-[[9-ethyl-2-(5-fluoro-1H-indol-4-yl)-6-morpholino-purin-8-yl]methyl]-4-piperidyl]-2-pyrrolidone Formula: C29H35FN8O2 MolecularWeight: 546.639003

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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)N7CCCC7=O

Isomeric SMILES

CCN1C(=NC2=C1N=C(N=C2N3CCOCC3)C4=C(C=CC5=C4C=CN5)F)CN6CCC(CC6)N7CCCC7=O

InChI

InChI=1S/C29H35FN8O2/c1-2-37-23(18-35-12-8-19(9-13-35)38-11-3-4-24(38)39)32-26-28(36-14-16-40-17-15-36)33-27(34-29(26)37)25-20-7-10-31-22(20)6-5-21(25)30/h5-7,10,19,31H,2-4,8-9,11-18H2,1H3