N2,9-bis(3-ethoxyphenyl)-6-morpholin-4-yl-purine-2,8-diamine

Systemtic Name: N2,9-bis(3-ethoxyphenyl)-6-morpholin-4-yl-purine-2,8-diamine Openeye Name: N2,9-bis(3-ethoxyphenyl)-6-morpholino-purine-2,8-diamine CAS Name: N2,9-bis(3-ethoxyphenyl)-6-(4-morpholinyl)purine-2,8-diamine IUPAC Name: 2-N,9-bis(3-ethoxyphenyl)-6-morpholin-4-ylpurine-2,8-diamine Traditional Name: (8-amino-6-morpholino-9-m-phenetyl-purin-2-yl)-m-phenetyl-amine Formula: C25H29N7O3 MolecularWeight: 475.54286

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)NC2=NC3=C(C(=N2)N4CCOCC4)N=C(N3C5=CC(=CC=C5)OCC)N

Isomeric SMILES

CCOC1=CC=CC(=C1)NC2=NC3=C(C(=N2)N4CCOCC4)N=C(N3C5=CC(=CC=C5)OCC)N

InChI

InChI=1S/C25H29N7O3/c1-3-34-19-9-5-7-17(15-19)27-25-29-22(31-11-13-33-14-12-31)21-23(30-25)32(24(26)28-21)18-8-6-10-20(16-18)35-4-2/h5-10,15-16H,3-4,11-14H2,1-2H3,(H2,26,28)(H,27,29,30)