9-[2-(5-fluoranyl-2,2-dimethyl-1,3-dioxan-5-yl)ethyl]-6-phenylmethoxy-purin-2-amine

Systemtic Name: 9-[2-(5-fluoranyl-2,2-dimethyl-1,3-dioxan-5-yl)ethyl]-6-phenylmethoxy-purin-2-amine Openeye Name: 6-benzyloxy-9-[2-(5-fluoro-2,2-dimethyl-1,3-dioxan-5-yl)ethyl]purin-2-amine CAS Name: 9-[2-(5-fluoro-2,2-dimethyl-1,3-dioxan-5-yl)ethyl]-6-phenylmethoxy-2-purinamine IUPAC Name: 9-[2-(5-fluoro-2,2-dimethyl-1,3-dioxan-5-yl)ethyl]-6-phenylmethoxypurin-2-amine Traditional Name: [6-benzoxy-9-[2-(5-fluoro-2,2-dimethyl-1,3-dioxan-5-yl)ethyl]purin-2-yl]amine Formula: C20H24FN5O3 MolecularWeight: 401.434663

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(CO1)(CCN2C=NC3=C2N=C(N=C3OCC4=CC=CC=C4)N)F)C

Isomeric SMILES

CC1(OCC(CO1)(CCN2C=NC3=C2N=C(N=C3OCC4=CC=CC=C4)N)F)C

InChI

InChI=1S/C20H24FN5O3/c1-19(2)28-11-20(21,12-29-19)8-9-26-13-23-15-16(26)24-18(22)25-17(15)27-10-14-6-4-3-5-7-14/h3-7,13H,8-12H2,1-2H3,(H2,22,24,25)