N2-butyl-8-methoxy-9-[(6-methoxypyridin-3-yl)methyl]purine-2,6-diamine

Systemtic Name: N2-butyl-8-methoxy-9-[(6-methoxypyridin-3-yl)methyl]purine-2,6-diamine Openeye Name: N2-butyl-8-methoxy-9-[(6-methoxy-3-pyridyl)methyl]purine-2,6-diamine CAS Name: N2-butyl-8-methoxy-9-[(6-methoxy-3-pyridinyl)methyl]purine-2,6-diamine IUPAC Name: 2-N-butyl-8-methoxy-9-[(6-methoxypyridin-3-yl)methyl]purine-2,6-diamine Traditional Name: [6-amino-8-methoxy-9-[(6-methoxy-3-pyridyl)methyl]purin-2-yl]-butyl-amine Formula: C17H23N7O2 MolecularWeight: 357.41022

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC2=C(C(=N1)N)N=C(N2CC3=CN=C(C=C3)OC)OC

Isomeric SMILES

CCCCNC1=NC2=C(C(=N1)N)N=C(N2CC3=CN=C(C=C3)OC)OC

InChI

InChI=1S/C17H23N7O2/c1-4-5-8-19-16-22-14(18)13-15(23-16)24(17(21-13)26-3)10-11-6-7-12(25-2)20-9-11/h6-7,9H,4-5,8,10H2,1-3H3,(H3,18,19,22,23)