6-azanyl-2-butoxy-9-[3-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(3-morpholin-4-ylpropyl)amino]propyl]-7H-purin-8-one

Systemtic Name: 6-azanyl-2-butoxy-9-[3-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(3-morpholin-4-ylpropyl)amino]propyl]-7H-purin-8-one Openeye Name: 6-amino-2-butoxy-9-[3-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(3-morpholinopropyl)amino]propyl]-7H-purin-8-one CAS Name: 6-amino-2-butoxy-9-[3-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[3-(4-morpholinyl)propyl]amino]propyl]-7H-purin-8-one IUPAC Name: 6-amino-2-butoxy-9-[3-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(3-morpholin-4-ylpropyl)amino]propyl]-7H-purin-8-one Traditional Name: 6-amino-2-butoxy-9-[3-[2,3-dihydro-1,4-benzodioxin-6-ylmethyl(3-morpholinopropyl)amino]propyl]-7H-purin-8-one Formula: C28H41N7O5 MolecularWeight: 555.66904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC2=C(C(=N1)N)NC(=O)N2CCCN(CCCN3CCOCC3)CC4=CC5=C(C=C4)OCCO5

Isomeric SMILES

CCCCOC1=NC2=C(C(=N1)N)NC(=O)N2CCCN(CCCN3CCOCC3)CC4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C28H41N7O5/c1-2-3-14-40-27-31-25(29)24-26(32-27)35(28(36)30-24)11-5-10-34(9-4-8-33-12-15-37-16-13-33)20-21-6-7-22-23(19-21)39-18-17-38-22/h6-7,19H,2-5,8-18,20H2,1H3,(H,30,36)(H2,29,31,32)