6-azanyl-2-butoxy-9-[(6-ethoxypyridin-3-yl)methyl]-7H-purin-8-one

Systemtic Name: 6-azanyl-2-butoxy-9-[(6-ethoxypyridin-3-yl)methyl]-7H-purin-8-one Openeye Name: 6-amino-2-butoxy-9-[(6-ethoxy-3-pyridyl)methyl]-7H-purin-8-one CAS Name: 6-amino-2-butoxy-9-[(6-ethoxy-3-pyridinyl)methyl]-7H-purin-8-one IUPAC Name: 6-amino-2-butoxy-9-[(6-ethoxypyridin-3-yl)methyl]-7H-purin-8-one Traditional Name: 6-amino-2-butoxy-9-[(6-ethoxy-3-pyridyl)methyl]-7H-purin-8-one Formula: C17H22N6O3 MolecularWeight: 358.39498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC2=C(C(=N1)N)NC(=O)N2CC3=CN=C(C=C3)OCC

Isomeric SMILES

CCCCOC1=NC2=C(C(=N1)N)NC(=O)N2CC3=CN=C(C=C3)OCC

InChI

InChI=1S/C17H22N6O3/c1-3-5-8-26-16-21-14(18)13-15(22-16)23(17(24)20-13)10-11-6-7-12(19-9-11)25-4-2/h6-7,9H,3-5,8,10H2,1-2H3,(H,20,24)(H2,18,21,22)