1-[1-[6-azanyl-8-(3-fluorophenyl)-9-methyl-purin-2-yl]ethenyl]cyclobutan-1-ol

Systemtic Name: 1-[1-[6-azanyl-8-(3-fluorophenyl)-9-methyl-purin-2-yl]ethenyl]cyclobutan-1-ol Openeye Name: 1-[1-[6-amino-8-(3-fluorophenyl)-9-methyl-purin-2-yl]vinyl]cyclobutanol CAS Name: 1-[1-[6-amino-8-(3-fluorophenyl)-9-methyl-2-purinyl]ethenyl]-1-cyclobutanol IUPAC Name: 1-[1-[6-amino-8-(3-fluorophenyl)-9-methylpurin-2-yl]ethenyl]cyclobutan-1-ol Traditional Name: 1-[1-[6-amino-8-(3-fluorophenyl)-9-methyl-purin-2-yl]vinyl]cyclobutanol Formula: C18H18FN5O MolecularWeight: 339.366823

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=NC(=N2)C(=C)C3(CCC3)O)N)N=C1C4=CC(=CC=C4)F

Isomeric SMILES

CN1C2=C(C(=NC(=N2)C(=C)C3(CCC3)O)N)N=C1C4=CC(=CC=C4)F

InChI

InChI=1S/C18H18FN5O/c1-10(18(25)7-4-8-18)15-22-14(20)13-17(23-15)24(2)16(21-13)11-5-3-6-12(19)9-11/h3,5-6,9,25H,1,4,7-8H2,2H3,(H2,20,22,23)