9-(4-fluorophenyl)-2-(oxan-4-yl)-3H-purine-2,8-diamine

Systemtic Name: 9-(4-fluorophenyl)-2-(oxan-4-yl)-3H-purine-2,8-diamine Openeye Name: 9-(4-fluorophenyl)-2-tetrahydropyran-4-yl-3H-purine-2,8-diamine CAS Name: 9-(4-fluorophenyl)-2-(4-oxanyl)-3H-purine-2,8-diamine IUPAC Name: 9-(4-fluorophenyl)-2-(oxan-4-yl)-3H-purine-2,8-diamine Traditional Name: [2-amino-9-(4-fluorophenyl)-2-tetrahydropyran-4-yl-3H-purin-8-yl]amine Formula: C16H19FN6O MolecularWeight: 330.360063

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1C2(NC3=C(C=N2)N=C(N3C4=CC=C(C=C4)F)N)N

Isomeric SMILES

C1COCCC1C2(NC3=C(C=N2)N=C(N3C4=CC=C(C=C4)F)N)N

InChI

InChI=1S/C16H19FN6O/c17-11-1-3-12(4-2-11)23-14-13(21-15(23)18)9-20-16(19,22-14)10-5-7-24-8-6-10/h1-4,9-10,22H,5-8,19H2,(H2,18,21)