4-[8-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-9-ethyl-2-(1H-indol-4-yl)purin-6-yl]morpholine

Systemtic Name: 4-[8-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-9-ethyl-2-(1H-indol-4-yl)purin-6-yl]morpholine Openeye Name: 4-[8-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-9-ethyl-2-(1H-indol-4-yl)purin-6-yl]morpholine CAS Name: 4-[8-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-9-ethyl-2-(1H-indol-4-yl)-6-purinyl]morpholine IUPAC Name: 4-[8-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-9-ethyl-2-(1H-indol-4-yl)purin-6-yl]morpholine Traditional Name: 4-[8-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-9-ethyl-2-(1H-indol-4-yl)purin-6-yl]morpholine Formula: C29H31N7O MolecularWeight: 493.60274

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC2=C1N=C(N=C2N3CCOCC3)C4=C5C=CNC5=CC=C4)CN6CCC7=CC=CC=C7C6

Isomeric SMILES

CCN1C(=NC2=C1N=C(N=C2N3CCOCC3)C4=C5C=CNC5=CC=C4)CN6CCC7=CC=CC=C7C6

InChI

InChI=1S/C29H31N7O/c1-2-36-25(19-34-13-11-20-6-3-4-7-21(20)18-34)31-26-28(35-14-16-37-17-15-35)32-27(33-29(26)36)23-8-5-9-24-22(23)10-12-30-24/h3-10,12,30H,2,11,13-19H2,1H3