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

Systemtic Name: 2-fluoranyl-9-(2-methoxyethyl)-8-[(3,4,5-trimethoxyphenyl)methyl]purin-6-amine Openeye Name: 2-fluoro-9-(2-methoxyethyl)-8-[(3,4,5-trimethoxyphenyl)methyl]purin-6-amine CAS Name: 2-fluoro-9-(2-methoxyethyl)-8-[(3,4,5-trimethoxyphenyl)methyl]-6-purinamine IUPAC Name: 2-fluoro-9-(2-methoxyethyl)-8-[(3,4,5-trimethoxyphenyl)methyl]purin-6-amine Traditional Name: [2-fluoro-9-(2-methoxyethyl)-8-(3,4,5-trimethoxybenzyl)purin-6-yl]amine Formula: C18H22FN5O4 MolecularWeight: 391.396783

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=NC2=C1N=C(N=C2N)F)CC3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

COCCN1C(=NC2=C1N=C(N=C2N)F)CC3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C18H22FN5O4/c1-25-6-5-24-13(21-14-16(20)22-18(19)23-17(14)24)9-10-7-11(26-2)15(28-4)12(8-10)27-3/h7-8H,5-6,9H2,1-4H3,(H2,20,22,23)