9-(cyclobutylmethyl)-2-fluoranyl-8-[(3,4,5-trimethoxyphenyl)methyl]purin-6-amine

Systemtic Name: 9-(cyclobutylmethyl)-2-fluoranyl-8-[(3,4,5-trimethoxyphenyl)methyl]purin-6-amine Openeye Name: 9-(cyclobutylmethyl)-2-fluoro-8-[(3,4,5-trimethoxyphenyl)methyl]purin-6-amine CAS Name: 9-(cyclobutylmethyl)-2-fluoro-8-[(3,4,5-trimethoxyphenyl)methyl]-6-purinamine IUPAC Name: 9-(cyclobutylmethyl)-2-fluoro-8-[(3,4,5-trimethoxyphenyl)methyl]purin-6-amine Traditional Name: [9-(cyclobutylmethyl)-2-fluoro-8-(3,4,5-trimethoxybenzyl)purin-6-yl]amine Formula: C20H24FN5O3 MolecularWeight: 401.434663

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CC2=NC3=C(N2CC4CCC4)N=C(N=C3N)F

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CC2=NC3=C(N2CC4CCC4)N=C(N=C3N)F

InChI

InChI=1S/C20H24FN5O3/c1-27-13-7-12(8-14(28-2)17(13)29-3)9-15-23-16-18(22)24-20(21)25-19(16)26(15)10-11-5-4-6-11/h7-8,11H,4-6,9-10H2,1-3H3,(H2,22,24,25)