1-[[9-ethyl-2-(1H-indol-4-yl)-6-morpholin-4-yl-purin-8-yl]methyl]-4-morpholin-4-yl-piperidine-4-carboxamide

Systemtic Name: 1-[[9-ethyl-2-(1H-indol-4-yl)-6-morpholin-4-yl-purin-8-yl]methyl]-4-morpholin-4-yl-piperidine-4-carboxamide Openeye Name: 1-[[9-ethyl-2-(1H-indol-4-yl)-6-morpholino-purin-8-yl]methyl]-4-morpholino-piperidine-4-carboxamide CAS Name: 1-[[9-ethyl-2-(1H-indol-4-yl)-6-(4-morpholinyl)-8-purinyl]methyl]-4-(4-morpholinyl)-4-piperidinecarboxamide IUPAC Name: 1-[[9-ethyl-2-(1H-indol-4-yl)-6-morpholin-4-ylpurin-8-yl]methyl]-4-morpholin-4-ylpiperidine-4-carboxamide Traditional Name: 1-[[9-ethyl-2-(1H-indol-4-yl)-6-morpholino-purin-8-yl]methyl]-4-morpholino-isonipecotamide Formula: C30H39N9O3 MolecularWeight: 573.68916

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC2=C1N=C(N=C2N3CCOCC3)C4=C5C=CNC5=CC=C4)CN6CCC(CC6)(C(=O)N)N7CCOCC7

Isomeric SMILES

CCN1C(=NC2=C1N=C(N=C2N3CCOCC3)C4=C5C=CNC5=CC=C4)CN6CCC(CC6)(C(=O)N)N7CCOCC7

InChI

InChI=1S/C30H39N9O3/c1-2-39-24(20-36-10-7-30(8-11-36,29(31)40)38-14-18-42-19-15-38)33-25-27(37-12-16-41-17-13-37)34-26(35-28(25)39)22-4-3-5-23-21(22)6-9-32-23/h3-6,9,32H,2,7-8,10-20H2,1H3,(H2,31,40)